2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone

Systemtic Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Openeye Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-[(2R)-2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-[(2R)-2-thiophen-2-yl-1-pyrrolidinyl]ethanone IUPAC Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Traditional Name: 2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-[(2R)-2-(2-thienyl)pyrrolidino]ethanone Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N2CCCC2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N2CCC[C@@H]2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4OS2/c1-2-23-19(15-8-4-3-5-9-15)21-22-20(23)27-14-18(25)24-12-6-10-16(24)17-11-7-13-26-17/h3-5,7-9,11,13,16H,2,6,10,12,14H2,1H3/t16-/m1/s1