N-[4-bromanyl-2-(3-methylsulfanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)phenyl]propanamide

Systemtic Name: N-[4-bromanyl-2-(3-methylsulfanyl-5-oxidanylidene-2H-1,2,4-triazin-6-yl)phenyl]propanamide Openeye Name: N-[4-bromo-2-(3-methylsulfanyl-5-oxo-2H-1,2,4-triazin-6-yl)phenyl]propanamide CAS Name: N-[4-bromo-2-[3-(methylthio)-5-oxo-2H-1,2,4-triazin-6-yl]phenyl]propanamide IUPAC Name: N-[4-bromo-2-(3-methylsulfanyl-5-oxo-2H-1,2,4-triazin-6-yl)phenyl]propanamide Traditional Name: N-[4-bromo-2-[5-keto-3-(methylthio)-2H-1,2,4-triazin-6-yl]phenyl]propionamide Formula: C13H13BrN4O2S MolecularWeight: 369.23692

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)Br)C2=NNC(=NC2=O)SC

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)Br)C2=NNC(=NC2=O)SC

InChI

InChI=1S/C13H13BrN4O2S/c1-3-10(19)15-9-5-4-7(14)6-8(9)11-12(20)16-13(21-2)18-17-11/h4-6H,3H2,1-2H3,(H,15,19)(H,16,18,20)