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

Systemtic Name: N-(4-bromophenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-bromophenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(4-bromophenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-bromophenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-bromophenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C13H15BrN4OS MolecularWeight: 355.2534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SC(C)C(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NN=C(N1C)SC(C)C(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H15BrN4OS/c1-8(20-13-17-16-9(2)18(13)3)12(19)15-11-6-4-10(14)5-7-11/h4-8H,1-3H3,(H,15,19)