methyl 1-[2-(phenylmethylsulfanyl)phenyl]carbonylindole-3-carboxylate

Systemtic Name: methyl 1-[2-(phenylmethylsulfanyl)phenyl]carbonylindole-3-carboxylate Openeye Name: methyl 1-(2-benzylsulfanylbenzoyl)indole-3-carboxylate CAS Name: 1-[oxo-[2-(phenylmethylthio)phenyl]methyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-benzylsulfanylbenzoyl)indole-3-carboxylate Traditional Name: 1-[2-(benzylthio)benzoyl]indole-3-carboxylic acid methyl ester Formula: C24H19NO3S MolecularWeight: 401.47756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)C(=O)C3=CC=CC=C3SCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)C(=O)C3=CC=CC=C3SCC4=CC=CC=C4

InChI

InChI=1S/C24H19NO3S/c1-28-24(27)20-15-25(21-13-7-5-11-18(20)21)23(26)19-12-6-8-14-22(19)29-16-17-9-3-2-4-10-17/h2-15H,16H2,1H3