ethyl 5-[[3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]quinoxalin-2-yl]amino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[[3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]quinoxalin-2-yl]amino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[3-[(4-chloro-3-nitro-phenyl)sulfonylamino]quinoxalin-2-yl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[3-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-quinoxalinyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[3-[(4-chloro-3-nitrophenyl)sulfonylamino]quinoxalin-2-yl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[3-[(4-chloro-3-nitro-phenyl)sulfonylamino]quinoxalin-2-yl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C22H18ClN5O6S2 MolecularWeight: 547.99122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C22H18ClN5O6S2/c1-3-34-22(29)19-12(2)10-18(35-19)26-20-21(25-16-7-5-4-6-15(16)24-20)27-36(32,33)13-8-9-14(23)17(11-13)28(30)31/h4-11H,3H2,1-2H3,(H,24,26)(H,25,27)