3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-4-(2,4,6-trimethylphenyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-4-(2,4,6-trimethylphenyl)-1H-1,2,4-triazol-5-one Openeye Name: 3-(2-morpholino-2-oxo-ethyl)sulfanyl-4-(2,4,6-trimethylphenyl)-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-(2,4,6-trimethylphenyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-4-(2,4,6-trimethylphenyl)-1H-1,2,4-triazol-5-one Traditional Name: 3-[(2-keto-2-morpholino-ethyl)thio]-4-mesityl-1H-1,2,4-triazol-5-one Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C(=O)NN=C2SCC(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C(=O)NN=C2SCC(=O)N3CCOCC3)C

InChI

InChI=1S/C17H22N4O3S/c1-11-8-12(2)15(13(3)9-11)21-16(23)18-19-17(21)25-10-14(22)20-4-6-24-7-5-20/h8-9H,4-7,10H2,1-3H3,(H,18,23)