3-nitro-4-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-N-[2-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-N-[2-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-nitro-4-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-N-[2-(trifluoromethyl)phenyl]benzamide CAS Name: 3-nitro-4-[[2-oxo-2-(phenethylamino)ethyl]thio]-N-[2-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-N-[2-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-[[2-keto-2-(phenethylamino)ethyl]thio]-3-nitro-N-[2-(trifluoromethyl)phenyl]benzamide Formula: C24H20F3N3O4S MolecularWeight: 503.49351

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C24H20F3N3O4S/c25-24(26,27)18-8-4-5-9-19(18)29-23(32)17-10-11-21(20(14-17)30(33)34)35-15-22(31)28-13-12-16-6-2-1-3-7-16/h1-11,14H,12-13,15H2,(H,28,31)(H,29,32)