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

Systemtic Name: 1-[6-bromanyl-2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-yl]-3-methyl-urea Openeye Name: 1-[6-bromo-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-methyl-urea CAS Name: 1-[6-bromo-2-[4-(1-piperazinyl)anilino]-7-pyrido[2,3-d]pyrimidinyl]-3-methylurea IUPAC Name: 1-[6-bromo-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-methylurea Traditional Name: 1-[6-bromo-2-(4-piperazinoanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-methyl-urea Formula: C19H21BrN8O MolecularWeight: 457.32704

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=C(C=C2C=NC(=NC2=N1)NC3=CC=C(C=C3)N4CCNCC4)Br

Isomeric SMILES

CNC(=O)NC1=C(C=C2C=NC(=NC2=N1)NC3=CC=C(C=C3)N4CCNCC4)Br

InChI

InChI=1S/C19H21BrN8O/c1-21-19(29)27-17-15(20)10-12-11-23-18(26-16(12)25-17)24-13-2-4-14(5-3-13)28-8-6-22-7-9-28/h2-5,10-11,22H,6-9H2,1H3,(H3,21,23,24,25,26,27,29)