methyl 4-cyano-5-[2-(2,3-dihydroindol-1-yl)ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-5-[2-(2,3-dihydroindol-1-yl)ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-[(2-indolin-1-ylacetyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-(2,3-dihydroindol-1-yl)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-5-[[2-(2,3-dihydroindol-1-yl)acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[(2-indolin-1-ylacetyl)amino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CN2CCC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CN2CCC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C18H17N3O3S/c1-11-13(9-19)17(25-16(11)18(23)24-2)20-15(22)10-21-8-7-12-5-3-4-6-14(12)21/h3-6H,7-8,10H2,1-2H3,(H,20,22)