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

Systemtic Name: (4S,5R)-4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxamide Openeye Name: (4S,5R)-4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxamide CAS Name: (4S,5R)-4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxamide IUPAC Name: (4S,5R)-4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxamide Traditional Name: (4S,5R)-4-(4-bromophenyl)-N-(2,3-dimethylphenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxamide Formula: C20H20BrN3O2 MolecularWeight: 414.2957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2C(NC(=O)NC2=C)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)[C@@H]2[C@H](NC(=O)NC2=C)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrN3O2/c1-11-5-4-6-16(12(11)2)23-19(25)17-13(3)22-20(26)24-18(17)14-7-9-15(21)10-8-14/h4-10,17-18H,3H2,1-2H3,(H,23,25)(H2,22,24,26)/t17-,18+/m0/s1