4-[2-[[1-(4-fluorophenyl)-2-methyl-propyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[[1-(4-fluorophenyl)-2-methyl-propyl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[[1-(4-fluorophenyl)-2-methyl-propyl]amino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[[1-(4-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[[1-(4-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[[1-(4-fluorophenyl)-2-methyl-propyl]amino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C19H20FN3O4S MolecularWeight: 405.443203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)F)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)F)NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C19H20FN3O4S/c1-11(2)18(12-3-6-14(20)7-4-12)22-17(24)10-28-16-8-5-13(19(21)25)9-15(16)23(26)27/h3-9,11,18H,10H2,1-2H3,(H2,21,25)(H,22,24)