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

Systemtic Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)propanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isobutyl-propanamide CAS Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylpropyl)propanamide IUPAC Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)propanamide Traditional Name: 2-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-isobutyl-propionamide Formula: C20H30N4OS2 MolecularWeight: 406.6084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4OS2/c1-14(2)13-21-19(25)15(3)27-20-23-22-18(12-17-10-7-11-26-17)24(20)16-8-5-4-6-9-16/h7,10-11,14-16H,4-6,8-9,12-13H2,1-3H3,(H,21,25)