4-methylidene-6-phenyl-2-sulfanylidene-1,3-diazinane-5-carboxamide

Systemtic Name: 4-methylidene-6-phenyl-2-sulfanylidene-1,3-diazinane-5-carboxamide Openeye Name: 4-methylene-6-phenyl-2-thioxo-hexahydropyrimidine-5-carboxamide CAS Name: 4-methylene-6-phenyl-2-sulfanylidene-1,3-diazinane-5-carboxamide IUPAC Name: 4-methylidene-6-phenyl-2-sulfanylidene-1,3-diazinane-5-carboxamide Traditional Name: 4-methylene-6-phenyl-2-thioxo-hexahydropyrimidine-5-carboxamide Formula: C12H13N3OS MolecularWeight: 247.31612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=S)N1)C2=CC=CC=C2)C(=O)N

Isomeric SMILES

C=C1C(C(NC(=S)N1)C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C12H13N3OS/c1-7-9(11(13)16)10(15-12(17)14-7)8-5-3-2-4-6-8/h2-6,9-10H,1H2,(H2,13,16)(H2,14,15,17)