(5S,6R)-4-methylidene-6-phenyl-2-sulfanylidene-N-[2-(trifluoromethyl)phenyl]-1,3-diazinane-5-carboxamide

Systemtic Name: (5S,6R)-4-methylidene-6-phenyl-2-sulfanylidene-N-[2-(trifluoromethyl)phenyl]-1,3-diazinane-5-carboxamide Openeye Name: (5S,6R)-4-methylene-6-phenyl-2-thioxo-N-[2-(trifluoromethyl)phenyl]hexahydropyrimidine-5-carboxamide CAS Name: (5S,6R)-4-methylene-6-phenyl-2-sulfanylidene-N-[2-(trifluoromethyl)phenyl]-1,3-diazinane-5-carboxamide IUPAC Name: (5S,6R)-4-methylidene-6-phenyl-2-sulfanylidene-N-[2-(trifluoromethyl)phenyl]-1,3-diazinane-5-carboxamide Traditional Name: (5S,6R)-4-methylene-6-phenyl-2-thioxo-N-[2-(trifluoromethyl)phenyl]hexahydropyrimidine-5-carboxamide Formula: C19H16F3N3OS MolecularWeight: 391.41005

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=S)N1)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C=C1[C@H]([C@@H](NC(=S)N1)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H16F3N3OS/c1-11-15(16(25-18(27)23-11)12-7-3-2-4-8-12)17(26)24-14-10-6-5-9-13(14)19(20,21)22/h2-10,15-16H,1H2,(H,24,26)(H2,23,25,27)/t15-,16+/m1/s1