4-methyl-N-[1-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[1-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-nitro-benzamide Openeye Name: N-isobutyl-4-methyl-N-[1-[3-(m-tolyl)-4-oxo-quinazolin-2-yl]ethyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[1-[3-(3-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-N-(2-methylpropyl)-3-nitrobenzamide IUPAC Name: 4-methyl-N-[1-[3-(3-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-isobutyl-N-[1-[4-keto-3-(m-tolyl)quinazolin-2-yl]ethyl]-4-methyl-3-nitro-benzamide Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CC(C)C)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CC(C)C)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C29H30N4O4/c1-18(2)17-31(28(34)22-14-13-20(4)26(16-22)33(36)37)21(5)27-30-25-12-7-6-11-24(25)29(35)32(27)23-10-8-9-19(3)15-23/h6-16,18,21H,17H2,1-5H3