1-[6-fluoranyl-5-methyl-2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-yl]-3-propan-2-yl-urea

Systemtic Name: 1-[6-fluoranyl-5-methyl-2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-yl]-3-propan-2-yl-urea Openeye Name: 1-[6-fluoro-5-methyl-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-isopropyl-urea CAS Name: 1-[6-fluoro-5-methyl-2-[4-(1-piperazinyl)anilino]-7-pyrido[2,3-d]pyrimidinyl]-3-propan-2-ylurea IUPAC Name: 1-[6-fluoro-5-methyl-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-propan-2-ylurea Traditional Name: 1-[6-fluoro-5-methyl-2-(4-piperazinoanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-isopropyl-urea Formula: C22H27FN8O MolecularWeight: 438.501183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCNCC4)NC(=O)NC(C)C)F

Isomeric SMILES

CC1=C(C(=NC2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCNCC4)NC(=O)NC(C)C)F

InChI

InChI=1S/C22H27FN8O/c1-13(2)26-22(32)30-20-18(23)14(3)17-12-25-21(29-19(17)28-20)27-15-4-6-16(7-5-15)31-10-8-24-9-11-31/h4-7,12-13,24H,8-11H2,1-3H3,(H3,25,26,27,28,29,30,32)