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

Systemtic Name: [(5S,6S)-4-methylidene-6-(3-methylphenyl)-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-yl-methanone Openeye Name: [(5S,6S)-4-methylene-6-(m-tolyl)-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone CAS Name: [(5S,6S)-4-methylene-6-(3-methylphenyl)-2-sulfanylidene-1,3-diazinan-5-yl]-(4-morpholinyl)methanone IUPAC Name: [(5S,6S)-4-methylidene-6-(3-methylphenyl)-2-sulfanylidene-1,3-diazinan-5-yl]-morpholin-4-ylmethanone Traditional Name: [(5S,6S)-4-methylene-6-(m-tolyl)-2-thioxo-hexahydropyrimidin-5-yl]-morpholino-methanone Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O2S/c1-11-4-3-5-13(10-11)15-14(12(2)18-17(23)19-15)16(21)20-6-8-22-9-7-20/h3-5,10,14-15H,2,6-9H2,1H3,(H2,18,19,23)/t14-,15-/m1/s1