8-cyclopentyl-6-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pteridin-7-one

Systemtic Name: 8-cyclopentyl-6-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]pteridin-7-one Openeye Name: 8-cyclopentyl-6-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pteridin-7-one CAS Name: 8-cyclopentyl-6-methyl-2-[4-(4-methyl-1-piperazinyl)anilino]-7-pteridinone IUPAC Name: 8-cyclopentyl-6-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]pteridin-7-one Traditional Name: 8-cyclopentyl-6-methyl-2-[4-(4-methylpiperazino)anilino]pteridin-7-one Formula: C23H29N7O MolecularWeight: 419.52266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=NC2=CN=C(N=C2N(C1=O)C3CCCC3)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C23H29N7O/c1-16-22(31)30(19-5-3-4-6-19)21-20(25-16)15-24-23(27-21)26-17-7-9-18(10-8-17)29-13-11-28(2)12-14-29/h7-10,15,19H,3-6,11-14H2,1-2H3,(H,24,26,27)