2-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 2-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one Openeye Name: 2-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-(p-tolyl)-1,2-dihydroquinazolin-4-one CAS Name: 2-[3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-methoxyphenyl]-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 2-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-3-(4-methylphenyl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-(p-tolyl)-1,2-dihydroquinazolin-4-one Formula: C28H27N5O4 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)CN5C(=C(C(=N5)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)CN5C(=C(C(=N5)C)[N+](=O)[O-])C

InChI

InChI=1S/C28H27N5O4/c1-17-9-12-22(13-10-17)32-27(29-24-8-6-5-7-23(24)28(32)34)20-11-14-25(37-4)21(15-20)16-31-19(3)26(33(35)36)18(2)30-31/h5-15,27,29H,16H2,1-4H3