propan-2-yl 3-phenylsulfanyl-1H-indole-2-carboxylate

Systemtic Name: propan-2-yl 3-phenylsulfanyl-1H-indole-2-carboxylate Openeye Name: isopropyl 3-phenylsulfanyl-1H-indole-2-carboxylate CAS Name: 3-(phenylthio)-1H-indole-2-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-phenylsulfanyl-1H-indole-2-carboxylate Traditional Name: 3-(phenylthio)-1H-indole-2-carboxylic acid isopropyl ester Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C2=CC=CC=C2N1)SC3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C1=C(C2=CC=CC=C2N1)SC3=CC=CC=C3

InChI

InChI=1S/C18H17NO2S/c1-12(2)21-18(20)16-17(22-13-8-4-3-5-9-13)14-10-6-7-11-15(14)19-16/h3-12,19H,1-2H3