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

Systemtic Name: N-cycloheptyl-2-[[4-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cycloheptyl-2-[[4-ethyl-5-(4-isopropylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cycloheptyl-2-[[4-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cycloheptyl-2-[[4-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cycloheptyl-2-[(4-ethyl-5-p-cumenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H32N4OS MolecularWeight: 400.58068

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2CCCCCC2)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2CCCCCC2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H32N4OS/c1-4-26-21(18-13-11-17(12-14-18)16(2)3)24-25-22(26)28-15-20(27)23-19-9-7-5-6-8-10-19/h11-14,16,19H,4-10,15H2,1-3H3,(H,23,27)