2-[[4-azanyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-ethanamide Openeye Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-acetamide CAS Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-ethylacetamide IUPAC Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethylacetamide Traditional Name: 2-[[4-amino-5-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-ethyl-acetamide Formula: C18H24ClN5OS MolecularWeight: 393.93406

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN(C1CCCCC1)C(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H24ClN5OS/c1-2-23(15-9-4-3-5-10-15)16(25)12-26-18-22-21-17(24(18)20)13-7-6-8-14(19)11-13/h6-8,11,15H,2-5,9-10,12,20H2,1H3