methyl 2-indol-1-ylsulfanyl-2-phenyl-butanoate

Systemtic Name: methyl 2-indol-1-ylsulfanyl-2-phenyl-butanoate Openeye Name: methyl 2-indol-1-ylsulfanyl-2-phenyl-butanoate CAS Name: 2-(1-indolylthio)-2-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-indol-1-ylsulfanyl-2-phenylbutanoate Traditional Name: 2-(indol-1-ylthio)-2-phenyl-butyric acid methyl ester Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C(=O)OC)SN2C=CC3=CC=CC=C32

Isomeric SMILES

CCC(C1=CC=CC=C1)(C(=O)OC)SN2C=CC3=CC=CC=C32

InChI

InChI=1S/C19H19NO2S/c1-3-19(18(21)22-2,16-10-5-4-6-11-16)23-20-14-13-15-9-7-8-12-17(15)20/h4-14H,3H2,1-2H3