2,4-bis(chloranyl)-N-[4-methylsulfanyl-1-oxidanylidene-1-(2-pyridin-4-ylcarbonylhydrazinyl)butan-2-yl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[4-methylsulfanyl-1-oxidanylidene-1-(2-pyridin-4-ylcarbonylhydrazinyl)butan-2-yl]benzamide Openeye Name: 2,4-dichloro-N-[3-methylsulfanyl-1-[(pyridine-4-carbonylamino)carbamoyl]propyl]benzamide CAS Name: 2,4-dichloro-N-[4-(methylthio)-1-oxo-1-[[oxo(pyridin-4-yl)methyl]hydrazo]butan-2-yl]benzamide IUPAC Name: 2,4-dichloro-N-[4-methylsulfanyl-1-oxo-1-[2-(pyridine-4-carbonyl)hydrazinyl]butan-2-yl]benzamide Traditional Name: 2,4-dichloro-N-[1-(isonicotinamidocarbamoyl)-3-(methylthio)propyl]benzamide Formula: C18H18Cl2N4O3S MolecularWeight: 441.33152

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC(=O)C1=CC=NC=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CSCCC(C(=O)NNC(=O)C1=CC=NC=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H18Cl2N4O3S/c1-28-9-6-15(22-17(26)13-3-2-12(19)10-14(13)20)18(27)24-23-16(25)11-4-7-21-8-5-11/h2-5,7-8,10,15H,6,9H2,1H3,(H,22,26)(H,23,25)(H,24,27)