6-[[[3-(4-dimethylaminophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[3-(4-dimethylaminophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-allyl-6-[[[3-(4-dimethylaminophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[3-(4-dimethylaminophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-prop-2-enyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[3-(4-dimethylaminophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-2-prop-2-enylcyclohexa-2,4-dien-1-one Traditional Name: 2-allyl-6-[[[3-(4-dimethylaminophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C20H21N5OS MolecularWeight: 379.47864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NNC(=S)N2NC=C3C=CC=C(C3=O)CC=C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NNC(=S)N2NC=C3C=CC=C(C3=O)CC=C

InChI

InChI=1S/C20H21N5OS/c1-4-6-14-7-5-8-16(18(14)26)13-21-25-19(22-23-20(25)27)15-9-11-17(12-10-15)24(2)3/h4-5,7-13,21H,1,6H2,2-3H3,(H,23,27)