7-[[4-(4-methylpiperazin-1-yl)phenyl]amino]-1-propan-2-yl-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 7-[[4-(4-methylpiperazin-1-yl)phenyl]amino]-1-propan-2-yl-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 1-isopropyl-7-[4-(4-methylpiperazin-1-yl)anilino]pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-[4-(4-methyl-1-piperazinyl)anilino]-1-propan-2-yl-2-pyrimido[4,5-d]pyrimidinone IUPAC Name: 7-[4-(4-methylpiperazin-1-yl)anilino]-1-propan-2-ylpyrimido[4,5-d]pyrimidin-2-one Traditional Name: 1-isopropyl-7-[4-(4-methylpiperazino)anilino]pyrimido[4,5-d]pyrimidin-2-one Formula: C20H25N7O MolecularWeight: 379.4588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC(=NC=C2C=NC1=O)NC3=CC=C(C=C3)N4CCN(CC4)C

Isomeric SMILES

CC(C)N1C2=NC(=NC=C2C=NC1=O)NC3=CC=C(C=C3)N4CCN(CC4)C

InChI

InChI=1S/C20H25N7O/c1-14(2)27-18-15(13-22-20(27)28)12-21-19(24-18)23-16-4-6-17(7-5-16)26-10-8-25(3)9-11-26/h4-7,12-14H,8-11H2,1-3H3,(H,21,23,24)