methyl 2-(7-chloranyl-4-methoxy-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(7-chloranyl-4-methoxy-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-[7-chloro-4-methoxy-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[7-chloro-4-methoxy-2-[oxo(thiophen-2-yl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-chloro-4-methoxy-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[7-chloro-4-methoxy-2-(2-thenoylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C16H13ClN2O4S2 MolecularWeight: 396.86842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3=CC=CS3)N2CC(=O)OC

Isomeric SMILES

COC1=C2C(=C(C=C1)Cl)SC(=NC(=O)C3=CC=CS3)N2CC(=O)OC

InChI

InChI=1S/C16H13ClN2O4S2/c1-22-10-6-5-9(17)14-13(10)19(8-12(20)23-2)16(25-14)18-15(21)11-4-3-7-24-11/h3-7H,8H2,1-2H3