4-[2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-[[5-(3-indolylidene)-4-phenyl-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-[(5-indol-3-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]-N,N-dimethyl-benzamide Formula: C27H24N6O2S MolecularWeight: 496.58346

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5=CC=CC=C5

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5=CC=CC=C5

InChI

InChI=1S/C27H24N6O2S/c1-32(2)26(35)18-12-14-19(15-13-18)29-24(34)17-36-27-31-30-25(33(27)20-8-4-3-5-9-20)22-16-28-23-11-7-6-10-21(22)23/h3-16,30H,17H2,1-2H3,(H,29,34)