ethyl 3-[2-(phenylmethylsulfanyl)ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-(phenylmethylsulfanyl)ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[(2-benzylsulfanylacetyl)amino]-1H-indole-2-carboxylate CAS Name: 3-[[1-oxo-2-(phenylmethylthio)ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-benzylsulfanylacetyl)amino]-1H-indole-2-carboxylate Traditional Name: 3-[[2-(benzylthio)acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-2-25-20(24)19-18(15-10-6-7-11-16(15)21-19)22-17(23)13-26-12-14-8-4-3-5-9-14/h3-11,21H,2,12-13H2,1H3,(H,22,23)