methyl 2-(1-methylindol-2-yl)sulfanyl-2-phenyl-butanoate

Systemtic Name: methyl 2-(1-methylindol-2-yl)sulfanyl-2-phenyl-butanoate Openeye Name: methyl 2-(1-methylindol-2-yl)sulfanyl-2-phenyl-butanoate CAS Name: 2-[(1-methyl-2-indolyl)thio]-2-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-(1-methylindol-2-yl)sulfanyl-2-phenylbutanoate Traditional Name: 2-[(1-methylindol-2-yl)thio]-2-phenyl-butyric acid methyl ester Formula: C20H21NO2S MolecularWeight: 339.45124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C(=O)OC)SC2=CC3=CC=CC=C3N2C

Isomeric SMILES

CCC(C1=CC=CC=C1)(C(=O)OC)SC2=CC3=CC=CC=C3N2C

InChI

InChI=1S/C20H21NO2S/c1-4-20(19(22)23-3,16-11-6-5-7-12-16)24-18-14-15-10-8-9-13-17(15)21(18)2/h5-14H,4H2,1-3H3