3-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)sulfanyl-4-phenethyl-1H-1,2,4-triazol-5-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)SC2=NNC(=O)N2CCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCOCC1)SC2=NNC(=O)N2CCC3=CC=CC=C3

InChI

InChI=1S/C17H22N4O3S/c1-13(15(22)20-9-11-24-12-10-20)25-17-19-18-16(23)21(17)8-7-14-5-3-2-4-6-14/h2-6,13H,7-12H2,1H3,(H,18,23)