4-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[3-methylsulfanyl-1-[[3-(trifluoromethyl)phenyl]methylcarbamoyl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-(methylthio)-1-oxo-1-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-methylsulfanyl-1-oxo-1-[[3-(trifluoromethyl)phenyl]methylamino]butan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[3-(methylthio)-1-[[3-(trifluoromethyl)benzyl]carbamoyl]propyl]-3-nitro-benzamide Formula: C20H19ClF3N3O4S MolecularWeight: 489.89577

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC(=CC=C1)C(F)(F)F)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C(=O)NCC1=CC(=CC=C1)C(F)(F)F)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClF3N3O4S/c1-32-8-7-16(26-18(28)13-5-6-15(21)17(10-13)27(30)31)19(29)25-11-12-3-2-4-14(9-12)20(22,23)24/h2-6,9-10,16H,7-8,11H2,1H3,(H,25,29)(H,26,28)