[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (Q27097217)

[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (English)

19 October 2016

chemical formula

C₁₉H₁₈N₄O₃S₂

1 reference

[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (English)

19 October 2016

canonical SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)NC2=NNC(=S)S2)C3=CC=CC=C3

1 reference

[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (English)

19 October 2016

isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@H](CC(=O)NC2=NNC(=S)S2)C3=CC=CC=C3

1 reference

[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (English)

InChI=1S/C19H18N4O3S2/c24-16(21-17-22-23-19(27)28-17)11-15(14-9-5-2-6-10-14)20-18(25)26-12-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,20,25)(H,23,27)(H,21,22,24)/t15-/m1/s1

19 October 2016

Identifiers

InChI

1 reference

[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (English)

AWAKNMKLVLWIIQ-OAHLLOKOSA-N

19 October 2016

InChIKey

1 reference

[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (English)

19 October 2016

1 reference

Benzyl {(1R)-3-oxo-1-phenyl-3-[(5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)amino]propyl}carbamate (English)

19 October 2016

2 references

[2-(5-MERCAPTO-[1,3,4]THIADIAZOL-2-YLCARBAMOYL)-1-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER (English)

matched by identifier from

19 October 2016

InChIKey

AWAKNMKLVLWIIQ-OAHLLOKOSA-N

1 reference

1 reference

matched by identifier from

InChIKey

AWAKNMKLVLWIIQ-OAHLLOKOSA-N

0 references

0 references

1 reference

2USN (English)