methyl 2-(phenylsulfanylmethyl)-1H-indole-5-carboxylate

Systemtic Name: methyl 2-(phenylsulfanylmethyl)-1H-indole-5-carboxylate Openeye Name: methyl 2-(phenylsulfanylmethyl)-1H-indole-5-carboxylate CAS Name: 2-[(phenylthio)methyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(phenylsulfanylmethyl)-1H-indole-5-carboxylate Traditional Name: 2-[(phenylthio)methyl]-1H-indole-5-carboxylic acid methyl ester Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC(=C2)CSC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC(=C2)CSC3=CC=CC=C3

InChI

InChI=1S/C17H15NO2S/c1-20-17(19)12-7-8-16-13(9-12)10-14(18-16)11-21-15-5-3-2-4-6-15/h2-10,18H,11H2,1H3