5-methyl-2-[(4-piperazin-1-ylphenyl)amino]-8-propan-2-yl-pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 5-methyl-2-[(4-piperazin-1-ylphenyl)amino]-8-propan-2-yl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-isopropyl-5-methyl-2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-one CAS Name: 5-methyl-2-[4-(1-piperazinyl)anilino]-8-propan-2-yl-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 5-methyl-2-(4-piperazin-1-ylanilino)-8-propan-2-ylpyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-isopropyl-5-methyl-2-(4-piperazinoanilino)pyrido[2,3-d]pyrimidin-7-one Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCNCC4)C(C)C

Isomeric SMILES

CC1=CC(=O)N(C2=NC(=NC=C12)NC3=CC=C(C=C3)N4CCNCC4)C(C)C

InChI

InChI=1S/C21H26N6O/c1-14(2)27-19(28)12-15(3)18-13-23-21(25-20(18)27)24-16-4-6-17(7-5-16)26-10-8-22-9-11-26/h4-7,12-14,22H,8-11H2,1-3H3,(H,23,24,25)