4-[2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[[4-(4-fluorophenyl)thiazol-2-yl]amino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[[4-(4-fluorophenyl)-2-thiazolyl]amino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[[4-(4-fluorophenyl)thiazol-2-yl]amino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C18H13FN4O4S2 MolecularWeight: 432.448623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)CSC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])F

InChI

InChI=1S/C18H13FN4O4S2/c19-12-4-1-10(2-5-12)13-8-29-18(21-13)22-16(24)9-28-15-6-3-11(17(20)25)7-14(15)23(26)27/h1-8H,9H2,(H2,20,25)(H,21,22,24)