tert-butyl 4-[6-[[8-cyclopentyl-6-(1-ethoxyethenyl)-5-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]amino]pyridin-3-yl]-2,6-dimethyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[[8-cyclopentyl-6-(1-ethoxyethenyl)-5-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]amino]pyridin-3-yl]-2,6-dimethyl-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[6-[[8-cyclopentyl-6-(1-ethoxyvinyl)-5-methyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl]amino]-3-pyridyl]-2,6-dimethyl-piperazine-1-carboxylate CAS Name: 4-[6-[[8-cyclopentyl-6-(1-ethoxyethenyl)-5-methyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl]amino]-3-pyridinyl]-2,6-dimethyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[[8-cyclopentyl-6-(1-ethoxyethenyl)-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl]amino]pyridin-3-yl]-2,6-dimethylpiperazine-1-carboxylate Traditional Name: 4-[6-[[8-cyclopentyl-6-(1-ethoxyvinyl)-7-keto-5-methyl-pyrido[2,3-d]pyrimidin-2-yl]amino]-3-pyridyl]-2,6-dimethyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C33H45N7O4 MolecularWeight: 603.7549

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C)C1=C(C2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=NC=C(C=C4)N5CC(N(C(C5)C)C(=O)OC(C)(C)C)C)C

Isomeric SMILES

CCOC(=C)C1=C(C2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=NC=C(C=C4)N5CC(N(C(C5)C)C(=O)OC(C)(C)C)C)C

InChI

InChI=1S/C33H45N7O4/c1-9-43-23(5)28-22(4)26-17-35-31(37-29(26)40(30(28)41)24-12-10-11-13-24)36-27-15-14-25(16-34-27)38-18-20(2)39(21(3)19-38)32(42)44-33(6,7)8/h14-17,20-21,24H,5,9-13,18-19H2,1-4,6-8H3,(H,34,35,36,37)