[5-[[4-(piperidin-1-ylmethyl)phenyl]carbonylamino]pyridin-2-yl] 4-(6-methylpyridin-2-yl)piperazine-1-carboxylate

Systemtic Name: [5-[[4-(piperidin-1-ylmethyl)phenyl]carbonylamino]pyridin-2-yl] 4-(6-methylpyridin-2-yl)piperazine-1-carboxylate Openeye Name: [5-[[4-(1-piperidylmethyl)benzoyl]amino]-2-pyridyl] 4-(6-methyl-2-pyridyl)piperazine-1-carboxylate CAS Name: 4-(6-methyl-2-pyridinyl)-1-piperazinecarboxylic acid [5-[[oxo-[4-(1-piperidinylmethyl)phenyl]methyl]amino]-2-pyridinyl] ester IUPAC Name: [5-[[4-(piperidin-1-ylmethyl)benzoyl]amino]pyridin-2-yl] 4-(6-methylpyridin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(6-methyl-2-pyridyl)piperazine-1-carboxylic acid [5-[[4-(piperidinomethyl)benzoyl]amino]-2-pyridyl] ester Formula: C29H34N6O3 MolecularWeight: 514.61866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2CCN(CC2)C(=O)OC3=NC=C(C=C3)NC(=O)C4=CC=C(C=C4)CN5CCCCC5

Isomeric SMILES

CC1=NC(=CC=C1)N2CCN(CC2)C(=O)OC3=NC=C(C=C3)NC(=O)C4=CC=C(C=C4)CN5CCCCC5

InChI

InChI=1S/C29H34N6O3/c1-22-6-5-7-26(31-22)34-16-18-35(19-17-34)29(37)38-27-13-12-25(20-30-27)32-28(36)24-10-8-23(9-11-24)21-33-14-3-2-4-15-33/h5-13,20H,2-4,14-19,21H2,1H3,(H,32,36)