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

Systemtic Name: N-[2-[3-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]-4-methyl-benzamide Openeye Name: N-[2-[3-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]-4-methyl-benzamide CAS Name: N-[2-[3-[[2-(3-methoxyanilino)-2-oxoethyl]thio]-1-indolyl]ethyl]-4-methylbenzamide IUPAC Name: N-[2-[3-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-methylbenzamide Traditional Name: N-[2-[3-[[2-keto-2-(m-anisidino)ethyl]thio]indol-1-yl]ethyl]-4-methyl-benzamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H27N3O3S/c1-19-10-12-20(13-11-19)27(32)28-14-15-30-17-25(23-8-3-4-9-24(23)30)34-18-26(31)29-21-6-5-7-22(16-21)33-2/h3-13,16-17H,14-15,18H2,1-2H3,(H,28,32)(H,29,31)