methyl 3-(2-phenylsulfanylethylcarbamoyl)indole-1-carboxylate

Systemtic Name: methyl 3-(2-phenylsulfanylethylcarbamoyl)indole-1-carboxylate Openeye Name: methyl 3-(2-phenylsulfanylethylcarbamoyl)indole-1-carboxylate CAS Name: 3-[oxo-[2-(phenylthio)ethylamino]methyl]-1-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(2-phenylsulfanylethylcarbamoyl)indole-1-carboxylate Traditional Name: 3-[2-(phenylthio)ethylcarbamoyl]indole-1-carboxylic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C=C(C2=CC=CC=C21)C(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

COC(=O)N1C=C(C2=CC=CC=C21)C(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-24-19(23)21-13-16(15-9-5-6-10-17(15)21)18(22)20-11-12-25-14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,20,22)