methyl 3-(6-methoxy-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: methyl 3-(6-methoxy-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-[6-methoxy-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[6-methoxy-2-[oxo(thiophen-2-yl)methyl]imino-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[6-methoxy-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[6-methoxy-2-(2-thenoylimino)-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C17H16N2O4S2 MolecularWeight: 376.44994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CS3)S2)CCC(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CS3)S2)CCC(=O)OC

InChI

InChI=1S/C17H16N2O4S2/c1-22-11-5-6-12-14(10-11)25-17(19(12)8-7-15(20)23-2)18-16(21)13-4-3-9-24-13/h3-6,9-10H,7-8H2,1-2H3