3-(3,5-dimethylphenyl)-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]-1,2-dihydroquinazolin-4-one IUPAC Name: 3-(3,5-dimethylphenyl)-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one Formula: C27H25N5O4 MolecularWeight: 483.5185

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N5O4/c1-17-10-18(2)12-21(11-17)31-26(29-24-7-5-4-6-23(24)27(31)33)19-8-9-25(36-3)20(13-19)15-30-16-22(14-28-30)32(34)35/h4-14,16,26,29H,15H2,1-3H3