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

Systemtic Name: [2-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl] thiomorpholine-4-carbodithioate Openeye Name: [2-[3-(4-methoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl] thiomorpholine-4-carbodithioate CAS Name: 4-thiomorpholinecarbodithioic acid [2-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester IUPAC Name: [2-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl] thiomorpholine-4-carbodithioate Traditional Name: thiomorpholine-4-carbodithioic acid [2-keto-2-[5-(4-methoxyphenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethyl] ester Formula: C21H23N3O2S4 MolecularWeight: 477.68622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC(=S)N3CCSCC3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC(=S)N3CCSCC3)C4=CC=CS4

InChI

InChI=1S/C21H23N3O2S4/c1-26-16-6-4-15(5-7-16)18-13-17(19-3-2-10-29-19)22-24(18)20(25)14-30-21(27)23-8-11-28-12-9-23/h2-7,10,18H,8-9,11-14H2,1H3