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

Systemtic Name: N-(4-bromophenyl)-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-bromophenyl)-3-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-bromophenyl)-3-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-bromophenyl)-3-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H17BrN4OS MolecularWeight: 417.32278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN4OS/c1-13-4-2-3-5-16(13)23-12-20-22-18(23)25-11-10-17(24)21-15-8-6-14(19)7-9-15/h2-9,12H,10-11H2,1H3,(H,21,24)