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

Systemtic Name: N-(4-bromophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-bromophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-bromophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-bromophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C12H13BrN4OS MolecularWeight: 341.22682

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CN1C=NN=C1SCCC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H13BrN4OS/c1-17-8-14-16-12(17)19-7-6-11(18)15-10-4-2-9(13)3-5-10/h2-5,8H,6-7H2,1H3,(H,15,18)