[(4R,5S)-4-(3-fluorophenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-yl-methanone

Systemtic Name: [(4R,5S)-4-(3-fluorophenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-yl-methanone Openeye Name: [(4R,5S)-4-(3-fluorophenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone CAS Name: [(4R,5S)-4-(3-fluorophenyl)-6-methylene-2-sulfanylidene-1,3-diazinan-5-yl]-(4-morpholinyl)methanone IUPAC Name: [(4R,5S)-4-(3-fluorophenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-ylmethanone Traditional Name: [(4R,5S)-4-(3-fluorophenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone Formula: C16H18FN3O2S MolecularWeight: 335.396423

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=S)N1)C2=CC(=CC=C2)F)C(=O)N3CCOCC3

Isomeric SMILES

C=C1[C@H]([C@@H](NC(=S)N1)C2=CC(=CC=C2)F)C(=O)N3CCOCC3

InChI

InChI=1S/C16H18FN3O2S/c1-10-13(15(21)20-5-7-22-8-6-20)14(19-16(23)18-10)11-3-2-4-12(17)9-11/h2-4,9,13-14H,1,5-8H2,(H2,18,19,23)/t13-,14+/m1/s1