ethyl 2,4-dimethyl-5-[(3S)-3-[methyl(2-pyridin-2-ylethyl)amino]piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(3S)-3-[methyl(2-pyridin-2-ylethyl)amino]piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(3S)-3-[methyl-[2-(2-pyridyl)ethyl]amino]piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[(3S)-3-[methyl-[2-(2-pyridinyl)ethyl]amino]-1-piperidinyl]-oxomethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(3S)-3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(3S)-3-[methyl-[2-(2-pyridyl)ethyl]amino]piperidine-1-carbonyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCCC(C2)N(C)CCC3=CC=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCC[C@@H](C2)N(C)CCC3=CC=CC=N3)C

InChI

InChI=1S/C23H32N4O3/c1-5-30-23(29)20-16(2)21(25-17(20)3)22(28)27-13-8-10-19(15-27)26(4)14-11-18-9-6-7-12-24-18/h6-7,9,12,19,25H,5,8,10-11,13-15H2,1-4H3/t19-/m0/s1