ethyl 5-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethoxy]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethoxy]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethoxy]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethoxy]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[2-keto-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethoxy]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C27H22N2O5S MolecularWeight: 486.53898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NC3=NC4=C(S3)C=C(C=C4)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NC3=NC4=C(S3)C=C(C=C4)C)C5=CC=CC=C5

InChI

InChI=1S/C27H22N2O5S/c1-3-32-26(31)24-19-14-18(10-12-21(19)34-25(24)17-7-5-4-6-8-17)33-15-23(30)29-27-28-20-11-9-16(2)13-22(20)35-27/h4-14H,3,15H2,1-2H3,(H,28,29,30)