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

Systemtic Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone Openeye Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone CAS Name: 1-[2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone IUPAC Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanone Traditional Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidino]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]ethanone Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O3S2/c1-26-13-7-8-14(16(11-13)27-2)15-5-3-9-23(15)18(25)12-24-19(21-22-20(24)28)17-6-4-10-29-17/h4,6-8,10-11,15H,3,5,9,12H2,1-2H3,(H,22,28)