N-[2-[[5-indol-3-ylidene-4-(2-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[[5-indol-3-ylidene-4-(2-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[[5-indol-3-ylidene-4-(o-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[[5-(3-indolylidene)-4-(2-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[[5-indol-3-ylidene-4-(2-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[[5-indol-3-ylidene-4-(o-tolyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C25H22N6O2S MolecularWeight: 470.54618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C3C=NC4=CC=CC=C43)NN=C2SCC(=O)NC(=O)C5=CC=CN5C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C3C=NC4=CC=CC=C43)NN=C2SCC(=O)NC(=O)C5=CC=CN5C

InChI

InChI=1S/C25H22N6O2S/c1-16-8-3-6-11-20(16)31-23(18-14-26-19-10-5-4-9-17(18)19)28-29-25(31)34-15-22(32)27-24(33)21-12-7-13-30(21)2/h3-14,28H,15H2,1-2H3,(H,27,32,33)