2-[[4-(3-azanylpyrrolidin-1-yl)-3-chloranyl-phenyl]amino]-6-bromanyl-8-cyclopentyl-5-methyl-pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 2-[[4-(3-azanylpyrrolidin-1-yl)-3-chloranyl-phenyl]amino]-6-bromanyl-8-cyclopentyl-5-methyl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 2-[4-(3-aminopyrrolidin-1-yl)-3-chloro-anilino]-6-bromo-8-cyclopentyl-5-methyl-pyrido[2,3-d]pyrimidin-7-one CAS Name: 2-[4-(3-amino-1-pyrrolidinyl)-3-chloroanilino]-6-bromo-8-cyclopentyl-5-methyl-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 2-[4-(3-aminopyrrolidin-1-yl)-3-chloroanilino]-6-bromo-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one Traditional Name: 2-[4-(3-aminopyrrolidino)-3-chloro-anilino]-6-bromo-8-cyclopentyl-5-methyl-pyrido[2,3-d]pyrimidin-7-one Formula: C23H26BrClN6O MolecularWeight: 517.84914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=CC(=C(C=C3)N4CCC(C4)N)Cl)C5CCCC5)Br

Isomeric SMILES

CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=CC(=C(C=C3)N4CCC(C4)N)Cl)C5CCCC5)Br

InChI

InChI=1S/C23H26BrClN6O/c1-13-17-11-27-23(29-21(17)31(22(32)20(13)24)16-4-2-3-5-16)28-15-6-7-19(18(25)10-15)30-9-8-14(26)12-30/h6-7,10-11,14,16H,2-5,8-9,12,26H2,1H3,(H,27,28,29)