1-[6-bromanyl-2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-yl]-3-cyclohexyl-urea

Systemtic Name: 1-[6-bromanyl-2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-yl]-3-cyclohexyl-urea Openeye Name: 1-[6-bromo-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-cyclohexyl-urea CAS Name: 1-[6-bromo-2-[4-(1-piperazinyl)anilino]-7-pyrido[2,3-d]pyrimidinyl]-3-cyclohexylurea IUPAC Name: 1-[6-bromo-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-cyclohexylurea Traditional Name: 1-[6-bromo-2-(4-piperazinoanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-cyclohexyl-urea Formula: C24H29BrN8O MolecularWeight: 525.44406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=C(C=C3C=NC(=NC3=N2)NC4=CC=C(C=C4)N5CCNCC5)Br

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=C(C=C3C=NC(=NC3=N2)NC4=CC=C(C=C4)N5CCNCC5)Br

InChI

InChI=1S/C24H29BrN8O/c25-20-14-16-15-27-23(28-18-6-8-19(9-7-18)33-12-10-26-11-13-33)31-21(16)30-22(20)32-24(34)29-17-4-2-1-3-5-17/h6-9,14-15,17,26H,1-5,10-13H2,(H3,27,28,29,30,31,32,34)