4-methyl-3-nitro-N-[4-[2-oxidanylidene-3-(phenylmethyl)-1,3-diazinan-1-yl]phenyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[4-[2-oxidanylidene-3-(phenylmethyl)-1,3-diazinan-1-yl]phenyl]benzamide Openeye Name: N-[4-(3-benzyl-2-oxo-hexahydropyrimidin-1-yl)phenyl]-4-methyl-3-nitro-benzamide CAS Name: 4-methyl-3-nitro-N-[4-[2-oxo-3-(phenylmethyl)-1,3-diazinan-1-yl]phenyl]benzamide IUPAC Name: N-[4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-(3-benzyl-2-keto-hexahydropyrimidin-1-yl)phenyl]-4-methyl-3-nitro-benzamide Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O4/c1-18-8-9-20(16-23(18)29(32)33)24(30)26-21-10-12-22(13-11-21)28-15-5-14-27(25(28)31)17-19-6-3-2-4-7-19/h2-4,6-13,16H,5,14-15,17H2,1H3,(H,26,30)