(2Z,6S)-2-imino-6-methyl-3-{3-[(4R)-2-oxo-4-phenylpyrrolidin-1-yl]benzyl}-6-(propan-2-yl)tetrahydropyrimidin-4(1H)-one (Q27456621)

CHEMBL3401342 (English)

19 October 2016

chemical formula

C₂₅H₃₀N₄O₂

1 reference

CHEMBL3401342 (English)

19 October 2016

canonical SMILES

CC(C)C1(CC(=O)N(C(=N1)N)CC2=CC(=CC=C2)N3CC(CC3=O)C4=CC=CC=C4)C

1 reference

CHEMBL3401342 (English)

19 October 2016

isomeric SMILES

CC(C)[C@@]1(CC(=O)N(C(=N1)N)CC2=CC(=CC=C2)N3C[C@H](CC3=O)C4=CC=CC=C4)C

1 reference

CHEMBL3401342 (English)

InChI=1S/C25H30N4O2/c1-17(2)25(3)14-23(31)29(24(26)27-25)15-18-8-7-11-21(12-18)28-16-20(13-22(28)30)19-9-5-4-6-10-19/h4-12,17,20H,13-16H2,1-3H3,(H2,26,27)/t20-,25-/m0/s1

19 October 2016

Identifiers

InChI

1 reference

CHEMBL3401342 (English)

VBYHYTJHKFQNCE-CPJSRVTESA-N

19 October 2016

InChIKey

1 reference

CHEMBL3401342 (English)

19 October 2016

1 reference

(6S)-2-Imino-6-isopropyl-6-methyl-3-{3-[(4R)-2-oxo-4-phenyl-1-pyrrolidinyl]benzyl}tetrahydro-4(1H)-pyrimidinone (English)

19 October 2016

2 references

CHEMBL3401342 (English)

matched by identifier from

19 October 2016

InChIKey

VBYHYTJHKFQNCE-CPJSRVTESA-N

1 reference

CHEMBL3401342 (English)

19 October 2016

1 reference

0 references

1 reference

4XX4 (English)