4-methyl-N-[2-[3-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]benzamide

Systemtic Name: 4-methyl-N-[2-[3-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]benzamide Openeye Name: 4-methyl-N-[2-[3-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]benzamide CAS Name: 4-methyl-N-[2-[3-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]benzamide IUPAC Name: 4-methyl-N-[2-[3-[2-(3-methylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]benzamide Traditional Name: N-[2-[3-[[2-keto-2-(m-toluidino)ethyl]thio]indol-1-yl]ethyl]-4-methyl-benzamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCCN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC=CC(=C4)C

InChI

InChI=1S/C27H27N3O2S/c1-19-10-12-21(13-11-19)27(32)28-14-15-30-17-25(23-8-3-4-9-24(23)30)33-18-26(31)29-22-7-5-6-20(2)16-22/h3-13,16-17H,14-15,18H2,1-2H3,(H,28,32)(H,29,31)