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

Systemtic Name: methyl 2-[(7-ethoxy-1-benzofuran-2-yl)carbonylimino]-3-prop-2-enyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-allyl-2-(7-ethoxybenzofuran-2-carbonyl)imino-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(7-ethoxy-2-benzofuranyl)-oxomethyl]imino-3-prop-2-enyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(7-ethoxy-1-benzofuran-2-carbonyl)imino-3-prop-2-enyl-1,3-benzothiazole-6-carboxylate Traditional Name: 3-allyl-2-(7-ethoxybenzofuran-2-carbonyl)imino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C23H20N2O5S MolecularWeight: 436.4803

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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)CC=C

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O5S/c1-4-11-25-16-10-9-15(22(27)28-3)13-19(16)31-23(25)24-21(26)18-12-14-7-6-8-17(29-5-2)20(14)30-18/h4,6-10,12-13H,1,5,11H2,2-3H3