2-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-cyclopentyl-amino]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-cyclopentyl-amino]-N-cyclohexyl-ethanamide Openeye Name: 2-[[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-cyclopentyl-amino]-N-cyclohexyl-acetamide CAS Name: 2-[[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-cyclopentylamino]-N-cyclohexylacetamide IUPAC Name: 2-[[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-cyclopentylamino]-N-cyclohexylacetamide Traditional Name: 2-[[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetyl]-cyclopentyl-amino]-N-cyclohexyl-acetamide Formula: C28H41N5O2S MolecularWeight: 511.72244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N(CC(=O)NC3CCCCC3)C4CCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N(CC(=O)NC3CCCCC3)C4CCCC4

InChI

InChI=1S/C28H41N5O2S/c1-28(2,3)21-16-14-20(15-17-21)26-30-31-27(32(26)4)36-19-25(35)33(23-12-8-9-13-23)18-24(34)29-22-10-6-5-7-11-22/h14-17,22-23H,5-13,18-19H2,1-4H3,(H,29,34)