3-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 3-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H22N4OS2 MolecularWeight: 350.50208

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCCC(=O)N)CC3=CC=CS3

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCCC(=O)N)CC3=CC=CS3

InChI

InChI=1S/C16H22N4OS2/c17-14(21)8-10-23-16-19-18-15(11-13-7-4-9-22-13)20(16)12-5-2-1-3-6-12/h4,7,9,12H,1-3,5-6,8,10-11H2,(H2,17,21)