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

Systemtic Name: [(4S,5S)-4-(4-chlorophenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-yl-methanone Openeye Name: [(4S,5S)-4-(4-chlorophenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone CAS Name: [(4S,5S)-4-(4-chlorophenyl)-6-methylene-2-sulfanylidene-1,3-diazinan-5-yl]-(4-morpholinyl)methanone IUPAC Name: [(4S,5S)-4-(4-chlorophenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-ylmethanone Traditional Name: [(4S,5S)-4-(4-chlorophenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone Formula: C16H18ClN3O2S MolecularWeight: 351.85102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN3O2S/c1-10-13(15(21)20-6-8-22-9-7-20)14(19-16(23)18-10)11-2-4-12(17)5-3-11/h2-5,13-14H,1,6-9H2,(H2,18,19,23)/t13-,14-/m1/s1