N-cyclohexyl-2-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylsulfanyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylsulfanyl]ethanamide Openeye Name: N-cyclohexyl-2-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methylsulfanyl]acetamide CAS Name: N-cyclohexyl-2-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylthio]acetamide IUPAC Name: N-cyclohexyl-2-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylsulfanyl]acetamide Traditional Name: N-cyclohexyl-2-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methylthio]acetamide Formula: C16H21N5OS MolecularWeight: 331.43584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSCC2=NC(=NN2)C3=CC=NC=C3

Isomeric SMILES

C1CCC(CC1)NC(=O)CSCC2=NC(=NN2)C3=CC=NC=C3

InChI

InChI=1S/C16H21N5OS/c22-15(18-13-4-2-1-3-5-13)11-23-10-14-19-16(21-20-14)12-6-8-17-9-7-12/h6-9,13H,1-5,10-11H2,(H,18,22)(H,19,20,21)