N-(3-methylbutylcarbamoyl)-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-[(3-methylbutylamino)-oxomethyl]-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(3-methylbutylcarbamoyl)-2-[[4-(2-methylphenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(isoamylcarbamoyl)-2-[[4-(o-tolyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C17H22N4O2S3 MolecularWeight: 410.57718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC(=O)NC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC(=O)NC(=O)NCCC(C)C

InChI

InChI=1S/C17H22N4O2S3/c1-11(2)8-9-18-15(23)19-14(22)10-25-16-20-21(17(24)26-16)13-7-5-4-6-12(13)3/h4-7,11H,8-10H2,1-3H3,(H2,18,19,22,23)