N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-sulfonamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-sulfonamide Openeye Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitro-phenyl]-6-methyl-2,4-dioxo-1H-pyrimidine-5-sulfonamide CAS Name: N-[3-[(4-fluorophenyl)thio]-5-nitrophenyl]-6-methyl-2,4-dioxo-1H-pyrimidine-5-sulfonamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanyl-5-nitrophenyl]-6-methyl-2,4-dioxo-1H-pyrimidine-5-sulfonamide Traditional Name: N-[3-[(4-fluorophenyl)thio]-5-nitro-phenyl]-2,4-diketo-6-methyl-1H-pyrimidine-5-sulfonamide Formula: C17H13FN4O6S2 MolecularWeight: 452.436723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)S(=O)(=O)NC2=CC(=CC(=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)S(=O)(=O)NC2=CC(=CC(=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H13FN4O6S2/c1-9-15(16(23)20-17(24)19-9)30(27,28)21-11-6-12(22(25)26)8-14(7-11)29-13-4-2-10(18)3-5-13/h2-8,21H,1H3,(H2,19,20,23,24)