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

Systemtic Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)-1-pyrrolidino-ethanone Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)N3CCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)N3CCCC3

InChI

InChI=1S/C16H20N4O2S/c1-2-22-13-7-5-12(6-8-13)15-17-18-16(23)20(15)11-14(21)19-9-3-4-10-19/h5-8H,2-4,9-11H2,1H3,(H,18,23)