ethyl 3-methyl-2-(5-nitrofuran-2-yl)carbonylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-methyl-2-(5-nitrofuran-2-yl)carbonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-methyl-2-(5-nitrofuran-2-carbonyl)imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-methyl-2-[(5-nitro-2-furanyl)-oxomethyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-2-(5-nitrofuran-2-carbonyl)imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-methyl-2-(5-nitro-2-furoyl)imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C16H13N3O6S MolecularWeight: 375.35592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(O3)[N+](=O)[O-])S2)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(O3)[N+](=O)[O-])S2)C

InChI

InChI=1S/C16H13N3O6S/c1-3-24-15(21)9-4-5-10-12(8-9)26-16(18(10)2)17-14(20)11-6-7-13(25-11)19(22)23/h4-8H,3H2,1-2H3