2-[[5-[(2-chloranylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[[5-[(2-chloranylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-ethanamide Openeye Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-acetamide CAS Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-cycloheptylacetamide IUPAC Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptylacetamide Traditional Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-cycloheptyl-acetamide Formula: C20H27ClN4O2S MolecularWeight: 422.97198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2CCCCCC2)COC3=CC=CC=C3Cl

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2CCCCCC2)COC3=CC=CC=C3Cl

InChI

InChI=1S/C20H27ClN4O2S/c1-2-25-18(13-27-17-12-8-7-11-16(17)21)23-24-20(25)28-14-19(26)22-15-9-5-3-4-6-10-15/h7-8,11-12,15H,2-6,9-10,13-14H2,1H3,(H,22,26)