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

Systemtic Name: 6-bromanyl-8-cyclopentyl-5-methyl-2-[(5-piperazin-1-ylsulfonylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one Openeye Name: 6-bromo-8-cyclopentyl-5-methyl-2-[(5-piperazin-1-ylsulfonyl-2-pyridyl)amino]pyrido[2,3-d]pyrimidin-7-one CAS Name: 6-bromo-8-cyclopentyl-5-methyl-2-[[5-(1-piperazinylsulfonyl)-2-pyridinyl]amino]-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 6-bromo-8-cyclopentyl-5-methyl-2-[(5-piperazin-1-ylsulfonylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one Traditional Name: 6-bromo-8-cyclopentyl-5-methyl-2-[(5-piperazinosulfonyl-2-pyridyl)amino]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)N4CCNCC4)C5CCCC5)Br

Isomeric SMILES

CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=NC=C(C=C3)S(=O)(=O)N4CCNCC4)C5CCCC5)Br

InChI

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