N-methyl-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide

Systemtic Name: N-methyl-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide Openeye Name: N-methyl-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide CAS Name: N-methyl-2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide IUPAC Name: N-methyl-2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acetamide Formula: C27H22N6O4 MolecularWeight: 494.50138

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CC3=CN(N=C3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C27H22N6O4/c1-31(17-24-28-23-10-6-5-9-22(23)27(35)29-24)25(34)15-19-16-32(20-7-3-2-4-8-20)30-26(19)18-11-13-21(14-12-18)33(36)37/h2-14,16H,15,17H2,1H3,(H,28,29,35)