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

Systemtic Name: (4R,5S)-4-(4-tert-butylphenyl)-6-methylidene-N-(3-nitrophenyl)-2-oxidanylidene-1,3-diazinane-5-carboxamide Openeye Name: (4R,5S)-4-(4-tert-butylphenyl)-6-methylene-N-(3-nitrophenyl)-2-oxo-hexahydropyrimidine-5-carboxamide CAS Name: (4R,5S)-4-(4-tert-butylphenyl)-6-methylene-N-(3-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxamide IUPAC Name: (4R,5S)-4-(4-tert-butylphenyl)-6-methylidene-N-(3-nitrophenyl)-2-oxo-1,3-diazinane-5-carboxamide Traditional Name: (4R,5S)-4-(4-tert-butylphenyl)-2-keto-6-methylene-N-(3-nitrophenyl)hexahydropyrimidine-5-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4/c1-13-18(20(27)24-16-6-5-7-17(12-16)26(29)30)19(25-21(28)23-13)14-8-10-15(11-9-14)22(2,3)4/h5-12,18-19H,1H2,2-4H3,(H,24,27)(H2,23,25,28)/t18-,19+/m1/s1