tert-butyl 4-[6-[(8-cyclopentyl-6-ethyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[(8-cyclopentyl-6-ethyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[6-[(8-cyclopentyl-6-ethyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridyl]piperazine-1-carboxylate CAS Name: 4-[6-[(8-cyclopentyl-6-ethyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl)amino]-3-pyridinyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[(8-cyclopentyl-6-ethyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[6-[(8-cyclopentyl-6-ethyl-7-keto-pyrido[2,3-d]pyrimidin-2-yl)amino]-3-pyridyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C28H37N7O3 MolecularWeight: 519.63848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=NC=C(C=C4)N5CCN(CC5)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=NC=C(C=C4)N5CCN(CC5)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H37N7O3/c1-5-19-16-20-17-30-26(32-24(20)35(25(19)36)21-8-6-7-9-21)31-23-11-10-22(18-29-23)33-12-14-34(15-13-33)27(37)38-28(2,3)4/h10-11,16-18,21H,5-9,12-15H2,1-4H3,(H,29,30,31,32)