6-bromanyl-8-cyclopentyl-2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 6-bromanyl-8-cyclopentyl-2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 6-bromo-8-cyclopentyl-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one CAS Name: 6-bromo-8-cyclopentyl-2-[4-(1-piperazinyl)anilino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 6-bromo-8-cyclopentyl-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one Traditional Name: 6-bromo-8-cyclopentyl-2-(4-piperazinoanilino)pyrido[2,3-d]pyrimidin-7-one Formula: C22H25BrN6O MolecularWeight: 469.3775

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=NC(=NC=C3C=C(C2=O)Br)NC4=CC=C(C=C4)N5CCNCC5

Isomeric SMILES

C1CCC(C1)N2C3=NC(=NC=C3C=C(C2=O)Br)NC4=CC=C(C=C4)N5CCNCC5

InChI

InChI=1S/C22H25BrN6O/c23-19-13-15-14-25-22(27-20(15)29(21(19)30)18-3-1-2-4-18)26-16-5-7-17(8-6-16)28-11-9-24-10-12-28/h5-8,13-14,18,24H,1-4,9-12H2,(H,25,26,27)