N-cycloheptyl-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-cycloheptyl-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-cycloheptyl-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-cycloheptyl-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cycloheptyl-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-cycloheptyl-2-[[5-[(2-methylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H28N4O2S MolecularWeight: 388.52692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NC(=NN2)SC(C)C(=O)NC3CCCCCC3

Isomeric SMILES

CC1=CC=CC=C1OCC2=NC(=NN2)SC(C)C(=O)NC3CCCCCC3

InChI

InChI=1S/C20H28N4O2S/c1-14-9-7-8-12-17(14)26-13-18-22-20(24-23-18)27-15(2)19(25)21-16-10-5-3-4-6-11-16/h7-9,12,15-16H,3-6,10-11,13H2,1-2H3,(H,21,25)(H,22,23,24)