2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[1-(phenylmethyl)-4-piperidinyl]acetamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H27N5OS2 MolecularWeight: 441.61268

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H27N5OS2/c1-2-27-21(19-9-6-14-29-19)24-25-22(27)30-16-20(28)23-18-10-12-26(13-11-18)15-17-7-4-3-5-8-17/h3-9,14,18H,2,10-13,15-16H2,1H3,(H,23,28)