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

Systemtic Name: N-aminocarbonyl-3-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-carbamoyl-3-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-carbamoyl-3-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-carbamoyl-3-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-carbamoyl-3-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propionamide Formula: C13H14ClN5O2S MolecularWeight: 339.80056

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC(=O)NC(=O)N)C2=CC=CC=C2Cl

Isomeric SMILES

CN1C(=NN=C1SCCC(=O)NC(=O)N)C2=CC=CC=C2Cl

InChI

InChI=1S/C13H14ClN5O2S/c1-19-11(8-4-2-3-5-9(8)14)17-18-13(19)22-7-6-10(20)16-12(15)21/h2-5H,6-7H2,1H3,(H3,15,16,20,21)