2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-[[5-(3-indolylidene)-4-phenyl-1H-1,2,4-triazol-3-yl]thio]-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-[4-(2-ketopyrrolidino)phenyl]acetamide Formula: C28H24N6O2S MolecularWeight: 508.59416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CSC3=NNC(=C4C=NC5=CC=CC=C54)N3C6=CC=CC=C6

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CSC3=NNC(=C4C=NC5=CC=CC=C54)N3C6=CC=CC=C6

InChI

InChI=1S/C28H24N6O2S/c35-25(30-19-12-14-20(15-13-19)33-16-6-11-26(33)36)18-37-28-32-31-27(34(28)21-7-2-1-3-8-21)23-17-29-24-10-5-4-9-22(23)24/h1-5,7-10,12-15,17,31H,6,11,16,18H2,(H,30,35)