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

Systemtic Name: 2-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide Openeye Name: 2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide CAS Name: N-[oxo-(2-thiophen-2-ylethylamino)methyl]-2-[[4-(phenylmethyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-thiophen-2-ylethylcarbamoyl)acetamide Traditional Name: 2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide Formula: C23H22N6O2S2 MolecularWeight: 478.58978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC(=O)NCCC3=CC=CS3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC(=O)NCCC3=CC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C23H22N6O2S2/c30-20(26-22(31)25-12-10-19-9-5-13-32-19)16-33-23-28-27-21(18-8-4-11-24-14-18)29(23)15-17-6-2-1-3-7-17/h1-9,11,13-14H,10,12,15-16H2,(H2,25,26,30,31)