N-(3-methyl-2-phenyl-butyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-(3-methyl-2-phenyl-butyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(3-methyl-2-phenyl-butyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(3-methyl-2-phenylbutyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(3-methyl-2-phenylbutyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(3-methyl-2-phenyl-butyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C20H24N4OS2 MolecularWeight: 400.56076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4OS2/c1-14(2)16(15-7-4-3-5-8-15)13-21-18(25)10-11-24-19(22-23-20(24)26)17-9-6-12-27-17/h3-9,12,14,16H,10-11,13H2,1-2H3,(H,21,25)(H,23,26)