7-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[methyl-[(1-phenyl-4-pyrazolyl)methyl]amino]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-6-nitro-1H-quinazolin-4-one Formula: C19H16N6O3 MolecularWeight: 376.36874

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C3=C(C=C4C(=C3)NC=NC4=O)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C3=C(C=C4C(=C3)NC=NC4=O)[N+](=O)[O-]

InChI

InChI=1S/C19H16N6O3/c1-23(10-13-9-22-24(11-13)14-5-3-2-4-6-14)17-8-16-15(7-18(17)25(27)28)19(26)21-12-20-16/h2-9,11-12H,10H2,1H3,(H,20,21,26)