2-[[4-azanyl-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-methyl-propanamide

Systemtic Name: 2-[[4-azanyl-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-methyl-propanamide Openeye Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-methyl-propanamide CAS Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-methylpropanamide IUPAC Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-methylpropanamide Traditional Name: 2-[[4-amino-5-(2-bromophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-methyl-propionamide Formula: C18H24BrN5OS MolecularWeight: 438.38506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1CCCCC1)SC2=NN=C(N2N)C3=CC=CC=C3Br

Isomeric SMILES

CC(C(=O)N(C)C1CCCCC1)SC2=NN=C(N2N)C3=CC=CC=C3Br

InChI

InChI=1S/C18H24BrN5OS/c1-12(17(25)23(2)13-8-4-3-5-9-13)26-18-22-21-16(24(18)20)14-10-6-7-11-15(14)19/h6-7,10-13H,3-5,8-9,20H2,1-2H3