[(E)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] N-(3-nitrosulfanylpropyl)carbamate

Systemtic Name: [(E)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] N-(3-nitrosulfanylpropyl)carbamate Openeye Name: [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-indolin-3-ylidene)-(2-thienyl)methyl] N-(3-nitrosulfanylpropyl)carbamate CAS Name: N-[3-(nitrothio)propyl]carbamic acid [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-3-indolylidene)-thiophen-2-ylmethyl] ester IUPAC Name: [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethyl] N-(3-nitrosulfanylpropyl)carbamate Traditional Name: N-[3-(nitrothio)propyl]carbamic acid [(E)-(1-carbamoyl-6-chloro-5-fluoro-2-keto-indolin-3-ylidene)-(2-thienyl)methyl] ester Formula: C18H14ClFN4O6S2 MolecularWeight: 500.908363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=C2C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)OC(=O)NCCCS[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)/C(=C\2/C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)/OC(=O)NCCCS[N+](=O)[O-]

InChI

InChI=1S/C18H14ClFN4O6S2/c19-10-8-12-9(7-11(10)20)14(16(25)23(12)17(21)26)15(13-3-1-5-31-13)30-18(27)22-4-2-6-32-24(28)29/h1,3,5,7-8H,2,4,6H2,(H2,21,26)(H,22,27)/b15-14+