N-butan-2-yl-2-[[4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-butan-2-yl-2-[[4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[[4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-butan-2-yl-2-[[4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-cyclohexyl-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]thio]-N-sec-butyl-acetamide Formula: C20H26Cl2N4OS MolecularWeight: 441.41764

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NN=C(N1C2CCCCC2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCC(C)NC(=O)CSC1=NN=C(N1C2CCCCC2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H26Cl2N4OS/c1-3-13(2)23-18(27)12-28-20-25-24-19(16-10-9-14(21)11-17(16)22)26(20)15-7-5-4-6-8-15/h9-11,13,15H,3-8,12H2,1-2H3,(H,23,27)