3-(2-chlorophenyl)-6-(3-cyclopentyloxy-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (Q27165397)

triazolothiadiazine, 28 (English)

9 October 2016

chemical formula

C₂₂H₂₁ClN₄O₂S

1 reference

triazolothiadiazine, 28 (English)

9 October 2016

canonical SMILES

COC1=C(C=C(C=C1)C2=NN3C(=NN=C3SC2)C4=CC=CC=C4Cl)OC5CCCC5

1 reference

triazolothiadiazine, 28 (English)

InChI=1S/C22H21ClN4O2S/c1-28-19-11-10-14(12-20(19)29-15-6-2-3-7-15)18-13-30-22-25-24-21(27(22)26-18)16-8-4-5-9-17(16)23/h4-5,8-12,15H,2-3,6-7,13H2,1H3

9 October 2016

Identifiers

InChI

1 reference

triazolothiadiazine, 28 (English)

KMUSXZAEXPZCDQ-UHFFFAOYSA-N

9 October 2016

InChIKey

2 references

triazolothiadiazine, 28 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

1 reference

3-(2-Chlorophenyl)-6-[3-(cyclopentyloxy)-4-methoxyphenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (English)

9 October 2016

1 reference

triazolothiadiazine, 28 (English)

9 October 2016

ChEBI ID

93700

mapping relation type

2 references

3-(2-chlorophenyl)-6-(3-cyclopentyloxy-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (English)

matched by identifier from

9 October 2016

International Chemical Identifier

InChI

InChI=1S/C22H21ClN4O2S/c1-28-19-11-10-14(12-20(19)29-15-6-2-3-7-15)18-13-30-22-25-24-21(27(22)26-18)16-8-4-5-9-17(16)23/h4-5,8-12,15H,2-3,6-7,13H2,1H3

1 reference