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

Systemtic Name: 2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-3-(phenylmethyl)-1,2-dihydroquinazolin-4-one Openeye Name: 3-benzyl-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one CAS Name: 2-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]-3-(phenylmethyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 3-benzyl-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one Traditional Name: 3-benzyl-2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1,2-dihydroquinazolin-4-one Formula: C26H23N5O4 MolecularWeight: 469.49192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)CN5C=C(C=N5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)CN5C=C(C=N5)[N+](=O)[O-]

InChI

InChI=1S/C26H23N5O4/c1-35-24-12-11-19(13-20(24)16-29-17-21(14-27-29)31(33)34)25-28-23-10-6-5-9-22(23)26(32)30(25)15-18-7-3-2-4-8-18/h2-14,17,25,28H,15-16H2,1H3