1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone

Systemtic Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone Openeye Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone CAS Name: 1-[2-(4-methoxyphenyl)-1-pyrrolidinyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone IUPAC Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone Traditional Name: 1-[2-(4-methoxyphenyl)pyrrolidino]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C19H20N4O2S2/c1-25-14-8-6-13(7-9-14)15-4-2-10-22(15)17(24)12-23-18(20-21-19(23)26)16-5-3-11-27-16/h3,5-9,11,15H,2,4,10,12H2,1H3,(H,21,26)