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

Systemtic Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-[3-(4-cyanobenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]-4-methyl-3-nitro-benzamide Formula: C26H23N5O4 MolecularWeight: 469.49192

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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=C(C=C4)C#N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C26H23N5O4/c1-18-3-8-21(15-24(18)31(34)35)25(32)28-22-9-11-23(12-10-22)30-14-2-13-29(26(30)33)17-20-6-4-19(16-27)5-7-20/h3-12,15H,2,13-14,17H2,1H3,(H,28,32)