3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-methylbutan-2-yl)propanamide

Systemtic Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-methylbutan-2-yl)propanamide Openeye Name: N-(1,1-dimethylpropyl)-3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-methylbutan-2-yl)propanamide IUPAC Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-methylbutan-2-yl)propanamide Traditional Name: N-tert-amyl-3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CCN1C(=NNC1=S)C2=CC=C(C=C2)OC

Isomeric SMILES

CCC(C)(C)NC(=O)CCN1C(=NNC1=S)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H24N4O2S/c1-5-17(2,3)18-14(22)10-11-21-15(19-20-16(21)24)12-6-8-13(23-4)9-7-12/h6-9H,5,10-11H2,1-4H3,(H,18,22)(H,20,24)