(4S,5S)-4-(2,4-dimethylphenyl)-6-methylidene-N-(3-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxamide

Systemtic Name: (4S,5S)-4-(2,4-dimethylphenyl)-6-methylidene-N-(3-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxamide Openeye Name: (4S,5S)-4-(2,4-dimethylphenyl)-6-methylene-N-(3-nitrophenyl)-2-oxo-hexahydropyrimidine-5-carboxamide CAS Name: (4S,5S)-4-(2,4-dimethylphenyl)-6-methylene-N-(3-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxamide IUPAC Name: (4S,5S)-4-(2,4-dimethylphenyl)-6-methylidene-N-(3-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxamide Traditional Name: (4S,5S)-4-(2,4-dimethylphenyl)-2-keto-6-methylene-N-(3-nitrophenyl)hexahydropyrimidine-5-carboxamide Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)[C@@H]2[C@@H](C(=C)NC(=O)N2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O4/c1-11-7-8-16(12(2)9-11)18-17(13(3)21-20(26)23-18)19(25)22-14-5-4-6-15(10-14)24(27)28/h4-10,17-18H,3H2,1-2H3,(H,22,25)(H2,21,23,26)/t17-,18-/m1/s1