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

Systemtic Name: tert-butyl 4-[4-[(8-cyclopentyl-6-ethanoyl-5-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl)amino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(6-acetyl-8-cyclopentyl-7-keto-5-methyl-pyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C30H38N6O4 MolecularWeight: 546.66052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)OC(C)(C)C)C5CCCC5)C(=O)C

Isomeric SMILES

CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)OC(C)(C)C)C5CCCC5)C(=O)C

InChI

InChI=1S/C30H38N6O4/c1-19-24-18-31-28(33-26(24)36(23-8-6-7-9-23)27(38)25(19)20(2)37)32-21-10-12-22(13-11-21)34-14-16-35(17-15-34)29(39)40-30(3,4)5/h10-13,18,23H,6-9,14-17H2,1-5H3,(H,31,32,33)