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

Systemtic Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-propanamide CAS Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-propylpropanamide IUPAC Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propylpropanamide Traditional Name: 2-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-propyl-propionamide Formula: C19H28N4OS2 MolecularWeight: 392.58182

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NN=C(N1C2CCCCC2)CC3=CC=CS3

Isomeric SMILES

CCCNC(=O)C(C)SC1=NN=C(N1C2CCCCC2)CC3=CC=CS3

InChI

InChI=1S/C19H28N4OS2/c1-3-11-20-18(24)14(2)26-19-22-21-17(13-16-10-7-12-25-16)23(19)15-8-5-4-6-9-15/h7,10,12,14-15H,3-6,8-9,11,13H2,1-2H3,(H,20,24)