ethyl (2Z)-2-(5-chloranylthiophen-2-yl)sulfonylimino-3-methyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl (2Z)-2-(5-chloranylthiophen-2-yl)sulfonylimino-3-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl (2Z)-2-[(5-chloro-2-thienyl)sulfonylimino]-3-methyl-1,3-benzothiazole-6-carboxylate CAS Name: (2Z)-2-[(5-chloro-2-thiophenyl)sulfonylimino]-3-methyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-2-(5-chlorothiophen-2-yl)sulfonylimino-3-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: (2Z)-2-[(5-chloro-2-thienyl)sulfonylimino]-3-methyl-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C15H13ClN2O4S3 MolecularWeight: 416.92272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NS(=O)(=O)C3=CC=C(S3)Cl)S2)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(/C(=N/S(=O)(=O)C3=CC=C(S3)Cl)/S2)C

InChI

InChI=1S/C15H13ClN2O4S3/c1-3-22-14(19)9-4-5-10-11(8-9)23-15(18(10)2)17-25(20,21)13-7-6-12(16)24-13/h4-8H,3H2,1-2H3/b17-15-