ethyl 3-(3-methoxyphenyl)sulfinyl-6-(pyridin-3-yloxymethyl)-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-(3-methoxyphenyl)sulfinyl-6-(pyridin-3-yloxymethyl)-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-(3-methoxyphenyl)sulfinyl-6-(3-pyridyloxymethyl)benzothiophene-2-carboxylate CAS Name: 3-(3-methoxyphenyl)sulfinyl-6-(3-pyridinyloxymethyl)-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-methoxyphenyl)sulfinyl-6-(pyridin-3-yloxymethyl)-1-benzothiophene-2-carboxylate Traditional Name: 3-(3-methoxyphenyl)sulfinyl-6-(3-pyridyloxymethyl)benzothiophene-2-carboxylic acid ethyl ester Formula: C24H21NO5S2 MolecularWeight: 467.55724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C=C(C=C2)COC3=CN=CC=C3)S(=O)C4=CC=CC(=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C=C(C=C2)COC3=CN=CC=C3)S(=O)C4=CC=CC(=C4)OC

InChI

InChI=1S/C24H21NO5S2/c1-3-29-24(26)22-23(32(27)19-8-4-6-17(13-19)28-2)20-10-9-16(12-21(20)31-22)15-30-18-7-5-11-25-14-18/h4-14H,3,15H2,1-2H3