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

Systemtic Name: methyl 2-(5-chloranylthiophen-2-yl)carbonylimino-3-ethyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(5-chlorothiophene-2-carbonyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(5-chloro-2-thiophenyl)-oxomethyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(5-chlorothiophene-2-carbonyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(5-chlorothiophene-2-carbonyl)imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H13ClN2O3S2/c1-3-19-10-5-4-9(15(21)22-2)8-12(10)24-16(19)18-14(20)11-6-7-13(17)23-11/h4-8H,3H2,1-2H3