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

Systemtic Name: [(4S,5S)-4-(2,5-dimethylphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-yl-methanone Openeye Name: [(4S,5S)-4-(2,5-dimethylphenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone CAS Name: [(4S,5S)-4-(2,5-dimethylphenyl)-6-methylene-2-sulfanylidene-1,3-diazinan-5-yl]-(4-morpholinyl)methanone IUPAC Name: [(4S,5S)-4-(2,5-dimethylphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-ylmethanone Traditional Name: [(4S,5S)-4-(2,5-dimethylphenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2C(C(=C)NC(=S)N2)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@@H]2[C@@H](C(=C)NC(=S)N2)C(=O)N3CCOCC3

InChI

InChI=1S/C18H23N3O2S/c1-11-4-5-12(2)14(10-11)16-15(13(3)19-18(24)20-16)17(22)21-6-8-23-9-7-21/h4-5,10,15-16H,3,6-9H2,1-2H3,(H2,19,20,24)/t15-,16-/m1/s1