ethyl 1-[2-[(4-methylphenyl)methylamino]pyrido[4,3-d]pyrimidin-5-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[(4-methylphenyl)methylamino]pyrido[4,3-d]pyrimidin-5-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(p-tolylmethylamino)pyrido[4,3-d]pyrimidin-5-yl]piperidine-3-carboxylate CAS Name: 1-[2-[(4-methylphenyl)methylamino]-5-pyrido[4,3-d]pyrimidinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-methylphenyl)methylamino]pyrido[4,3-d]pyrimidin-5-yl]piperidine-3-carboxylate Traditional Name: 1-[2-[(4-methylbenzyl)amino]pyrido[4,3-d]pyrimidin-5-yl]nipecotic acid ethyl ester Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=NC=CC3=NC(=NC=C32)NCC4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=NC=CC3=NC(=NC=C32)NCC4=CC=C(C=C4)C

InChI

InChI=1S/C23H27N5O2/c1-3-30-22(29)18-5-4-12-28(15-18)21-19-14-26-23(27-20(19)10-11-24-21)25-13-17-8-6-16(2)7-9-17/h6-11,14,18H,3-5,12-13,15H2,1-2H3,(H,25,26,27)