N-aminocarbonyl-2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-aminocarbonyl-2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-carbamoyl-2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-carbamoyl-2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-carbamoyl-2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-carbamoyl-2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C12H12ClN5O2S MolecularWeight: 325.77398

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC(=O)N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC(=O)N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H12ClN5O2S/c1-18-10(7-2-4-8(13)5-3-7)16-17-12(18)21-6-9(19)15-11(14)20/h2-5H,6H2,1H3,(H3,14,15,19,20)