methyl 4-ethyl-2-[(3-nitrophenyl)sulfonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-ethyl-2-[(3-nitrophenyl)sulfonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 4-ethyl-2-[(3-nitrophenyl)sulfonylamino]thiazole-5-carboxylate CAS Name: 4-ethyl-2-[(3-nitrophenyl)sulfonylamino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-2-[(3-nitrophenyl)sulfonylamino]-1,3-thiazole-5-carboxylate Traditional Name: 4-ethyl-2-[(3-nitrophenyl)sulfonylamino]thiazole-5-carboxylic acid methyl ester Formula: C13H13N3O6S2 MolecularWeight: 371.38882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCC1=C(SC(=N1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H13N3O6S2/c1-3-10-11(12(17)22-2)23-13(14-10)15-24(20,21)9-6-4-5-8(7-9)16(18)19/h4-7H,3H2,1-2H3,(H,14,15)