[3-ethanoyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] 2-phenylsulfanylethanoate

Systemtic Name: [3-ethanoyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] 2-phenylsulfanylethanoate Openeye Name: [3-acetyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [3-acetyl-1-(4-methoxyphenyl)-2-methyl-5-indolyl] ester IUPAC Name: [3-acetyl-1-(4-methoxyphenyl)-2-methylindol-5-yl] 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [3-acetyl-1-(4-methoxyphenyl)-2-methyl-indol-5-yl] ester Formula: C26H23NO4S MolecularWeight: 445.53012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OC(=O)CSC4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=CC(=C2)OC(=O)CSC4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C26H23NO4S/c1-17-26(18(2)28)23-15-21(31-25(29)16-32-22-7-5-4-6-8-22)13-14-24(23)27(17)19-9-11-20(30-3)12-10-19/h4-15H,16H2,1-3H3