N-(2-methyl-5-nitro-phenyl)-3-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-3-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]propanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-3-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanamide CAS Name: N-(2-methyl-5-nitrophenyl)-3-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-3-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]propanamide Traditional Name: 3-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H21N5O4/c1-13-7-8-14(25(28)29)11-17(13)22-19(26)9-10-24(2)12-18-21-16-6-4-3-5-15(16)20(27)23-18/h3-8,11H,9-10,12H2,1-2H3,(H,22,26)(H,21,23,27)