[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 4-methylthieno[2,3-b]indole-2-carboxylate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 4-methylthieno[2,3-b]indole-2-carboxylate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 4-methylthieno[2,3-b]indole-2-carboxylate CAS Name: 4-methyl-2-thieno[2,3-b]indolecarboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 4-methylthieno[2,3-b]indole-2-carboxylate Traditional Name: 4-methylthien[2,3-b]indole-2-carboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C1SC(=C3)C(=O)OCC(=O)N(C)CCC#N

Isomeric SMILES

CN1C2=CC=CC=C2C3=C1SC(=C3)C(=O)OCC(=O)N(C)CCC#N

InChI

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