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

Systemtic Name: 2-[[5-(3-azanylpyrrolidin-1-yl)sulfonylpyridin-2-yl]amino]-6-bromanyl-8-cyclopentyl-5-methyl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 2-[[5-(3-aminopyrrolidin-1-yl)sulfonyl-2-pyridyl]amino]-6-bromo-8-cyclopentyl-5-methyl-pyrido[2,3-d]pyrimidin-7-one CAS Name: 2-[[5-[(3-amino-1-pyrrolidinyl)sulfonyl]-2-pyridinyl]amino]-6-bromo-8-cyclopentyl-5-methyl-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 2-[[5-(3-aminopyrrolidin-1-yl)sulfonylpyridin-2-yl]amino]-6-bromo-8-cyclopentyl-5-methylpyrido[2,3-d]pyrimidin-7-one Traditional Name: 2-[[5-(3-aminopyrrolidino)sulfonyl-2-pyridyl]amino]-6-bromo-8-cyclopentyl-5-methyl-pyrido[2,3-d]pyrimidin-7-one Formula: C22H26BrN7O3S MolecularWeight: 548.45594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26BrN7O3S/c1-13-17-11-26-22(28-20(17)30(21(31)19(13)23)15-4-2-3-5-15)27-18-7-6-16(10-25-18)34(32,33)29-9-8-14(24)12-29/h6-7,10-11,14-15H,2-5,8-9,12,24H2,1H3,(H,25,26,27,28)