(7R)-8-cyclopentyl-7-ethyl-5-methyl-2-[[2-methyl-5-(4-methylpiperazin-1-yl)phenyl]amino]-7H-pteridin-6-one

Systemtic Name: (7R)-8-cyclopentyl-7-ethyl-5-methyl-2-[[2-methyl-5-(4-methylpiperazin-1-yl)phenyl]amino]-7H-pteridin-6-one Openeye Name: (7R)-8-cyclopentyl-7-ethyl-5-methyl-2-[2-methyl-5-(4-methylpiperazin-1-yl)anilino]-7H-pteridin-6-one CAS Name: (7R)-8-cyclopentyl-7-ethyl-5-methyl-2-[2-methyl-5-(4-methyl-1-piperazinyl)anilino]-7H-pteridin-6-one IUPAC Name: (7R)-8-cyclopentyl-7-ethyl-5-methyl-2-[2-methyl-5-(4-methylpiperazin-1-yl)anilino]-7H-pteridin-6-one Traditional Name: (7R)-8-cyclopentyl-7-ethyl-5-methyl-2-[2-methyl-5-(4-methylpiperazino)anilino]-7H-pteridin-6-one Formula: C26H37N7O MolecularWeight: 463.61828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=CN=C(N=C2N1C3CCCC3)NC4=C(C=CC(=C4)N5CCN(CC5)C)C)C

Isomeric SMILES

CC[C@@H]1C(=O)N(C2=CN=C(N=C2N1C3CCCC3)NC4=C(C=CC(=C4)N5CCN(CC5)C)C)C

InChI

InChI=1S/C26H37N7O/c1-5-22-25(34)31(4)23-17-27-26(29-24(23)33(22)19-8-6-7-9-19)28-21-16-20(11-10-18(21)2)32-14-12-30(3)13-15-32/h10-11,16-17,19,22H,5-9,12-15H2,1-4H3,(H,27,28,29)/t22-/m1/s1