[2-(3-methylphenyl)-2-oxidanylidene-1-(1,2,4-triazol-1-yl)ethyl] morpholine-4-carbodithioate

Systemtic Name: [2-(3-methylphenyl)-2-oxidanylidene-1-(1,2,4-triazol-1-yl)ethyl] morpholine-4-carbodithioate Openeye Name: [2-(m-tolyl)-2-oxo-1-(1,2,4-triazol-1-yl)ethyl] morpholine-4-carbodithioate CAS Name: 4-morpholinecarbodithioic acid [2-(3-methylphenyl)-2-oxo-1-(1,2,4-triazol-1-yl)ethyl] ester IUPAC Name: [2-(3-methylphenyl)-2-oxo-1-(1,2,4-triazol-1-yl)ethyl] morpholine-4-carbodithioate Traditional Name: morpholine-4-carbodithioic acid [2-keto-2-(m-tolyl)-1-(1,2,4-triazol-1-yl)ethyl] ester Formula: C16H18N4O2S2 MolecularWeight: 362.46972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(N2C=NC=N2)SC(=S)N3CCOCC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C(N2C=NC=N2)SC(=S)N3CCOCC3

InChI

InChI=1S/C16H18N4O2S2/c1-12-3-2-4-13(9-12)14(21)15(20-11-17-10-18-20)24-16(23)19-5-7-22-8-6-19/h2-4,9-11,15H,5-8H2,1H3