4-bromanyl-N-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide Openeye Name: 4-bromo-N-[2-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)ethyl]benzamide CAS Name: 4-bromo-N-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide IUPAC Name: 4-bromo-N-[2-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide Traditional Name: 4-bromo-N-[2-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)ethyl]benzamide Formula: C12H13BrN4OS MolecularWeight: 341.22682

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CCNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CN1C(=NNC1=S)CCNC(=O)C2=CC=C(C=C2)Br

InChI

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