N-[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[[4-(2-methylpropyl)phenyl]-thiophen-2-yl-methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(4-isobutylphenyl)-(2-thienyl)methyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[[4-(2-methylpropyl)phenyl]-thiophen-2-ylmethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[(4-isobutylphenyl)-(2-thienyl)methyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C22H28N4OS2 MolecularWeight: 428.61392

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC(C2=CC=C(C=C2)CC(C)C)C3=CC=CS3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC(C2=CC=C(C=C2)CC(C)C)C3=CC=CS3

InChI

InChI=1S/C22H28N4OS2/c1-4-6-19-24-25-22(28)26(19)14-20(27)23-21(18-7-5-12-29-18)17-10-8-16(9-11-17)13-15(2)3/h5,7-12,15,21H,4,6,13-14H2,1-3H3,(H,23,27)(H,25,28)