methyl 6-[(2-methylpiperidin-1-yl)methyl]-3-(2-phenylethanoylamino)thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 6-[(2-methylpiperidin-1-yl)methyl]-3-(2-phenylethanoylamino)thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 6-[(2-methyl-1-piperidyl)methyl]-3-[(2-phenylacetyl)amino]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 6-[(2-methyl-1-piperidinyl)methyl]-3-[(1-oxo-2-phenylethyl)amino]-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(2-methylpiperidin-1-yl)methyl]-3-[(2-phenylacetyl)amino]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 6-[(2-methylpiperidino)methyl]-3-[(2-phenylacetyl)amino]thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=NC3=C(C=C2)C(=C(S3)C(=O)OC)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1CCCCN1CC2=NC3=C(C=C2)C(=C(S3)C(=O)OC)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3S/c1-16-8-6-7-13-27(16)15-18-11-12-19-21(22(24(29)30-2)31-23(19)25-18)26-20(28)14-17-9-4-3-5-10-17/h3-5,9-12,16H,6-8,13-15H2,1-2H3,(H,26,28)