N-(4-fluoranyl-3-nitro-phenyl)-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-benzamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-benzamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-2-[2-(isopropylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(4-fluoro-3-nitrophenyl)-2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzamide Formula: C18H18FN3O4S MolecularWeight: 391.416623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C18H18FN3O4S/c1-11(2)20-17(23)10-27-16-6-4-3-5-13(16)18(24)21-12-7-8-14(19)15(9-12)22(25)26/h3-9,11H,10H2,1-2H3,(H,20,23)(H,21,24)