7,7-dimethyl-3-[2-(4-nitrophenyl)ethyl]-2-pyrimidin-4-yl-6,8-dihydro-1H-pyrimido[1,2-a]pyrimidin-4-one

Systemtic Name: 7,7-dimethyl-3-[2-(4-nitrophenyl)ethyl]-2-pyrimidin-4-yl-6,8-dihydro-1H-pyrimido[1,2-a]pyrimidin-4-one Openeye Name: 7,7-dimethyl-3-[2-(4-nitrophenyl)ethyl]-2-pyrimidin-4-yl-6,8-dihydro-1H-pyrimido[1,2-a]pyrimidin-4-one CAS Name: 7,7-dimethyl-3-[2-(4-nitrophenyl)ethyl]-2-(4-pyrimidinyl)-6,8-dihydro-1H-pyrimido[1,2-a]pyrimidin-4-one IUPAC Name: 7,7-dimethyl-3-[2-(4-nitrophenyl)ethyl]-2-pyrimidin-4-yl-6,8-dihydro-1H-pyrimido[1,2-a]pyrimidin-4-one Traditional Name: 7,7-dimethyl-3-[2-(4-nitrophenyl)ethyl]-2-(4-pyrimidyl)-6,8-dihydro-1H-pyrimido[1,2-a]pyrimidin-4-one Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN=C2NC(=C(C(=O)N2C1)CCC3=CC=C(C=C3)[N+](=O)[O-])C4=NC=NC=C4)C

Isomeric SMILES

CC1(CN=C2NC(=C(C(=O)N2C1)CCC3=CC=C(C=C3)[N+](=O)[O-])C4=NC=NC=C4)C

InChI

InChI=1S/C21H22N6O3/c1-21(2)11-23-20-25-18(17-9-10-22-13-24-17)16(19(28)26(20)12-21)8-5-14-3-6-15(7-4-14)27(29)30/h3-4,6-7,9-10,13H,5,8,11-12H2,1-2H3,(H,23,25)