methyl 2-(6-acetamido-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(6-acetamido-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-[6-acetamido-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-acetamido-2-[oxo(thiophen-2-yl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-acetamido-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-acetamido-2-(2-thenoylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C17H15N3O4S2 MolecularWeight: 389.4487

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CS3)S2)CC(=O)OC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CS3)S2)CC(=O)OC

InChI

InChI=1S/C17H15N3O4S2/c1-10(21)18-11-5-6-12-14(8-11)26-17(20(12)9-15(22)24-2)19-16(23)13-4-3-7-25-13/h3-8H,9H2,1-2H3,(H,18,21)