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

Systemtic Name: N-(4-bromophenyl)-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-bromophenyl)-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-bromophenyl)-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-bromophenyl)-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H19BrN4OS MolecularWeight: 407.32796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C17H19BrN4OS/c18-12-3-5-13(6-4-12)19-15(23)9-10-24-17-21-20-16(11-1-2-11)22(17)14-7-8-14/h3-6,11,14H,1-2,7-10H2,(H,19,23)