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

Systemtic Name: 2-[[5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-acetamide CAS Name: 2-[[5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-ethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethylacetamide Traditional Name: N-benzyl-2-[[5-cyclohexyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-ethyl-acetamide Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4CCCCC4

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4CCCCC4

InChI

InChI=1S/C26H32N4O2S/c1-3-29(18-20-10-6-4-7-11-20)24(31)19-33-26-28-27-25(21-12-8-5-9-13-21)30(26)22-14-16-23(32-2)17-15-22/h4,6-7,10-11,14-17,21H,3,5,8-9,12-13,18-19H2,1-2H3