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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C28H27N5O4/c1-18-26(33(35)36)19(2)32(30-18)17-22-15-21(13-14-25(22)37-3)27-29-24-12-8-7-11-23(24)28(34)31(27)16-20-9-5-4-6-10-20/h4-15,27,29H,16-17H2,1-3H3