(3E)-4-(benzotriazol-1-yl)-N-(4-chlorophenyl)hepta-3,6-dienethioamide

Systemtic Name: (3E)-4-(benzotriazol-1-yl)-N-(4-chlorophenyl)hepta-3,6-dienethioamide Openeye Name: (3E)-4-(benzotriazol-1-yl)-N-(4-chlorophenyl)hepta-3,6-dienethioamide CAS Name: (3E)-4-(1-benzotriazolyl)-N-(4-chlorophenyl)hepta-3,6-dienethioamide IUPAC Name: (3E)-4-(benzotriazol-1-yl)-N-(4-chlorophenyl)hepta-3,6-dienethioamide Traditional Name: (3E)-4-(benzotriazol-1-yl)-N-(4-chlorophenyl)hepta-3,6-dienethioamide Formula: C19H17ClN4S MolecularWeight: 368.88308

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(=CCC(=S)NC1=CC=C(C=C1)Cl)N2C3=CC=CC=C3N=N2

Isomeric SMILES

C=CC/C(=C\CC(=S)NC1=CC=C(C=C1)Cl)/N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H17ClN4S/c1-2-5-16(24-18-7-4-3-6-17(18)22-23-24)12-13-19(25)21-15-10-8-14(20)9-11-15/h2-4,6-12H,1,5,13H2,(H,21,25)/b16-12+