methyl 2-[2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(7-ethoxybenzofuran-2-carbonyl)imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(7-ethoxy-2-benzofuranyl)-oxomethyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(7-ethoxy-1-benzofuran-2-carbonyl)imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(7-ethoxybenzofuran-2-carbonyl)imino-6-mesyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C22H20N2O7S2 MolecularWeight: 488.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)C)CC(=O)OC

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)C)CC(=O)OC

InChI

InChI=1S/C22H20N2O7S2/c1-4-30-16-7-5-6-13-10-17(31-20(13)16)21(26)23-22-24(12-19(25)29-2)15-9-8-14(33(3,27)28)11-18(15)32-22/h5-11H,4,12H2,1-3H3