4-chloranyl-N-[1-[2-[(2-fluorophenyl)carbamothioyl]hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[1-[2-[(2-fluorophenyl)carbamothioyl]hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[1-[[(2-fluorophenyl)carbamothioylamino]carbamoyl]-3-methylsulfanyl-propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[1-[[(2-fluoroanilino)-sulfanylidenemethyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[1-[2-[(2-fluorophenyl)carbamothioyl]hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[1-[[(2-fluorophenyl)thiocarbamoylamino]carbamoyl]-3-(methylthio)propyl]-3-nitro-benzamide Formula: C19H19ClFN5O4S2 MolecularWeight: 499.966663

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC(=S)NC1=CC=CC=C1F)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C(=O)NNC(=S)NC1=CC=CC=C1F)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClFN5O4S2/c1-32-9-8-15(22-17(27)11-6-7-12(20)16(10-11)26(29)30)18(28)24-25-19(31)23-14-5-3-2-4-13(14)21/h2-7,10,15H,8-9H2,1H3,(H,22,27)(H,24,28)(H2,23,25,31)