ethyl 4-[2-(1-methylindol-3-yl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(1-methylindol-3-yl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(1-methylindol-3-yl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(1-methyl-3-indolyl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1-methylindol-3-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(1-methylindol-3-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)C

InChI

InChI=1S/C20H20N2O3S/c1-3-25-20(24)14-8-10-15(11-9-14)21-19(23)13-26-18-12-22(2)17-7-5-4-6-16(17)18/h4-12H,3,13H2,1-2H3,(H,21,23)