9-cyclopentyl-2-[[2-methoxy-4-[2-(4-methylpiperazin-1-yl)ethyl]phenyl]amino]-7-methyl-purin-8-one

Systemtic Name: 9-cyclopentyl-2-[[2-methoxy-4-[2-(4-methylpiperazin-1-yl)ethyl]phenyl]amino]-7-methyl-purin-8-one Openeye Name: 9-cyclopentyl-2-[2-methoxy-4-[2-(4-methylpiperazin-1-yl)ethyl]anilino]-7-methyl-purin-8-one CAS Name: 9-cyclopentyl-2-[2-methoxy-4-[2-(4-methyl-1-piperazinyl)ethyl]anilino]-7-methyl-8-purinone IUPAC Name: 9-cyclopentyl-2-[2-methoxy-4-[2-(4-methylpiperazin-1-yl)ethyl]anilino]-7-methylpurin-8-one Traditional Name: 9-cyclopentyl-2-[2-methoxy-4-[2-(4-methylpiperazino)ethyl]anilino]-7-methyl-purin-8-one Formula: C25H35N7O2 MolecularWeight: 465.5911

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC2=CC(=C(C=C2)NC3=NC=C4C(=N3)N(C(=O)N4C)C5CCCC5)OC

Isomeric SMILES

CN1CCN(CC1)CCC2=CC(=C(C=C2)NC3=NC=C4C(=N3)N(C(=O)N4C)C5CCCC5)OC

InChI

InChI=1S/C25H35N7O2/c1-29-12-14-31(15-13-29)11-10-18-8-9-20(22(16-18)34-3)27-24-26-17-21-23(28-24)32(25(33)30(21)2)19-6-4-5-7-19/h8-9,16-17,19H,4-7,10-15H2,1-3H3,(H,26,27,28)