2-[4-(4-bromanyl-3-methyl-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanylethanamide

Systemtic Name: 2-[4-(4-bromanyl-3-methyl-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanylethanamide Openeye Name: 2-[4-(4-bromo-3-methyl-phenyl)-3-oxo-pyrazin-2-yl]sulfanylacetamide CAS Name: 2-[[4-(4-bromo-3-methylphenyl)-3-oxo-2-pyrazinyl]thio]acetamide IUPAC Name: 2-[4-(4-bromo-3-methylphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-(4-bromo-3-methyl-phenyl)-3-keto-pyrazin-2-yl]thio]acetamide Formula: C13H12BrN3O2S MolecularWeight: 354.22228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C=CN=C(C2=O)SCC(=O)N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C=CN=C(C2=O)SCC(=O)N)Br

InChI

InChI=1S/C13H12BrN3O2S/c1-8-6-9(2-3-10(8)14)17-5-4-16-12(13(17)19)20-7-11(15)18/h2-6H,7H2,1H3,(H2,15,18)