2-[methyl-[[4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-ethanamide

Systemtic Name: 2-[methyl-[[4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-ethanamide Openeye Name: 2-[methyl-[[4-(o-tolyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-acetamide CAS Name: 2-[methyl-[[4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propylacetamide IUPAC Name: 2-[methyl-[[4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]amino]-N-propylacetamide Traditional Name: 2-[methyl-[[4-(o-tolyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]amino]-N-propyl-acetamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)CN1C(=S)N(C=N1)C2=CC=CC=C2C

Isomeric SMILES

CCCNC(=O)CN(C)CN1C(=S)N(C=N1)C2=CC=CC=C2C

InChI

InChI=1S/C16H23N5OS/c1-4-9-17-15(22)10-19(3)12-21-16(23)20(11-18-21)14-8-6-5-7-13(14)2/h5-8,11H,4,9-10,12H2,1-3H3,(H,17,22)