2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(2-pyridin-3-ylcarbonylhydrazinyl)butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(2-pyridin-3-ylcarbonylhydrazinyl)butan-2-yl]benzamide Openeye Name: 2-bromo-N-[3-methylsulfanyl-1-[(pyridine-3-carbonylamino)carbamoyl]propyl]benzamide CAS Name: 2-bromo-N-[4-(methylthio)-1-oxo-1-[[oxo(3-pyridinyl)methyl]hydrazo]butan-2-yl]benzamide IUPAC Name: 2-bromo-N-[4-methylsulfanyl-1-oxo-1-[2-(pyridine-3-carbonyl)hydrazinyl]butan-2-yl]benzamide Traditional Name: 2-bromo-N-[3-(methylthio)-1-(nicotinamidocarbamoyl)propyl]benzamide Formula: C18H19BrN4O3S MolecularWeight: 451.33746

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC(=O)C1=CN=CC=C1)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CSCCC(C(=O)NNC(=O)C1=CN=CC=C1)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H19BrN4O3S/c1-27-10-8-15(21-17(25)13-6-2-3-7-14(13)19)18(26)23-22-16(24)12-5-4-9-20-11-12/h2-7,9,11,15H,8,10H2,1H3,(H,21,25)(H,22,24)(H,23,26)