(5S,6R)-4-methylidene-6-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide

Systemtic Name: (5S,6R)-4-methylidene-6-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide Openeye Name: (5S,6R)-4-methylene-6-(p-tolyl)-2-thioxo-hexahydropyrimidine-5-carboxamide CAS Name: (5S,6R)-4-methylene-6-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide IUPAC Name: (5S,6R)-4-methylidene-6-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-5-carboxamide Traditional Name: (5S,6R)-4-methylene-6-(p-tolyl)-2-thioxo-hexahydropyrimidine-5-carboxamide Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=C)NC(=S)N2)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2[C@@H](C(=C)NC(=S)N2)C(=O)N

InChI

InChI=1S/C13H15N3OS/c1-7-3-5-9(6-4-7)11-10(12(14)17)8(2)15-13(18)16-11/h3-6,10-11H,2H2,1H3,(H2,14,17)(H2,15,16,18)/t10-,11+/m1/s1