[(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] 5-nitrososulfanylpentanoate

Systemtic Name: [(Z)-(1-aminocarbonyl-6-chloranyl-5-fluoranyl-2-oxidanylidene-indol-3-ylidene)-thiophen-2-yl-methyl] 5-nitrososulfanylpentanoate Openeye Name: [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-indolin-3-ylidene)-(2-thienyl)methyl] 5-nitrososulfanylpentanoate CAS Name: 5-(nitrosothio)pentanoic acid [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxo-3-indolylidene)-thiophen-2-ylmethyl] ester IUPAC Name: [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-oxoindol-3-ylidene)-thiophen-2-ylmethyl] 5-nitrososulfanylpentanoate Traditional Name: 5-(nitrosothio)valeric acid [(Z)-(1-carbamoyl-6-chloro-5-fluoro-2-keto-indolin-3-ylidene)-(2-thienyl)methyl] ester Formula: C19H15ClFN3O5S2 MolecularWeight: 483.920903

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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)CCCCSN=O

Isomeric SMILES

C1=CSC(=C1)/C(=C/2\C3=CC(=C(C=C3N(C2=O)C(=O)N)Cl)F)/OC(=O)CCCCSN=O

InChI

InChI=1S/C19H15ClFN3O5S2/c20-11-9-13-10(8-12(11)21)16(18(26)24(13)19(22)27)17(14-4-3-6-30-14)29-15(25)5-1-2-7-31-23-28/h3-4,6,8-9H,1-2,5,7H2,(H2,22,27)/b17-16-