[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-[(4-azanyl-3-nitro-phenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-[(4-azanyl-3-nitro-phenyl)sulfonylamino]ethanoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 2-[(4-amino-3-nitro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-amino-3-nitrophenyl)sulfonylamino]acetic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-amino-3-nitrophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-amino-3-nitro-phenyl)sulfonylamino]acetic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C15H13N5O7S2 MolecularWeight: 439.42302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)NCC(=O)OCC(=O)NC2=C(C=CS2)C#N)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)NCC(=O)OCC(=O)NC2=C(C=CS2)C#N)[N+](=O)[O-])N

InChI

InChI=1S/C15H13N5O7S2/c16-6-9-3-4-28-15(9)19-13(21)8-27-14(22)7-18-29(25,26)10-1-2-11(17)12(5-10)20(23)24/h1-5,18H,7-8,17H2,(H,19,21)