methyl 2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-3-methyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-3-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(7-ethoxybenzofuran-2-carbonyl)imino-3-methyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(7-ethoxy-2-benzofuranyl)-oxomethyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(7-ethoxy-1-benzofuran-2-carbonyl)imino-3-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(7-ethoxybenzofuran-2-carbonyl)imino-3-methyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C21H18N2O5S MolecularWeight: 410.44302

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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)C(=O)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O5S/c1-4-27-15-7-5-6-12-10-16(28-18(12)15)19(24)22-21-23(2)14-9-8-13(20(25)26-3)11-17(14)29-21/h5-11H,4H2,1-3H3