ethyl 4-[(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridin-2-yl)carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carbonyl)amino]piperidine-1-carboxylate CAS Name: 4-[[[4,6-dimethyl-3-(1-pyrrolyl)-2-thieno[2,3-b]pyridinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carbonyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(4,6-dimethyl-3-pyrrol-1-yl-thieno[2,3-b]pyridine-2-carbonyl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(C3=C(S2)N=C(C=C3C)C)N4C=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(C3=C(S2)N=C(C=C3C)C)N4C=CC=C4

InChI

InChI=1S/C22H26N4O3S/c1-4-29-22(28)26-11-7-16(8-12-26)24-20(27)19-18(25-9-5-6-10-25)17-14(2)13-15(3)23-21(17)30-19/h5-6,9-10,13,16H,4,7-8,11-12H2,1-3H3,(H,24,27)