2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-pyrrolidin-1-ylbutyl)ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-pyrrolidin-1-ylbutyl)ethanamide Openeye Name: 2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(2-pyrrolidin-1-ylbutyl)acetamide CAS Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[2-(1-pyrrolidinyl)butyl]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-pyrrolidin-1-ylbutyl)acetamide Traditional Name: 2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(2-pyrrolidinobutyl)acetamide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)C)N3CCCC3

Isomeric SMILES

CCC(CNC(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)C)N3CCCC3

InChI

InChI=1S/C19H27N5OS/c1-3-16(23-10-4-5-11-23)12-20-17(25)13-24-18(21-22-19(24)26)15-8-6-14(2)7-9-15/h6-9,16H,3-5,10-13H2,1-2H3,(H,20,25)(H,22,26)