[2-oxidanylidene-2-(3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)ethyl] morpholine-4-carbodithioate

Systemtic Name: [2-oxidanylidene-2-(3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)ethyl] morpholine-4-carbodithioate Openeye Name: [2-oxo-2-[3-phenyl-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethyl] morpholine-4-carbodithioate CAS Name: 4-morpholinecarbodithioic acid [2-oxo-2-(3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)ethyl] morpholine-4-carbodithioate Traditional Name: morpholine-4-carbodithioic acid [2-keto-2-[5-phenyl-3-(2-thienyl)-2-pyrazolin-1-yl]ethyl] ester Formula: C20H21N3O2S3 MolecularWeight: 431.59464

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)SCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=S)SCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O2S3/c24-19(14-28-20(26)22-8-10-25-11-9-22)23-17(15-5-2-1-3-6-15)13-16(21-23)18-7-4-12-27-18/h1-7,12,17H,8-11,13-14H2