2-methoxyethyl 2-[(4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl)sulfinyl]benzimidazole-1-carboxylate

Systemtic Name: 2-methoxyethyl 2-[(4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl)sulfinyl]benzimidazole-1-carboxylate Openeye Name: 2-methoxyethyl 2-[(4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl)sulfinyl]benzimidazole-1-carboxylate CAS Name: 2-[(4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl)sulfinyl]-1-benzimidazolecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-[(4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl)sulfinyl]benzimidazole-1-carboxylate Traditional Name: 2-[(4-methoxy-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl)sulfinyl]benzimidazole-1-carboxylic acid 2-methoxyethyl ester Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)N1C2=CC=CC=C2N=C1S(=O)C3CCCCC4=C(C=CN=C34)OC

Isomeric SMILES

COCCOC(=O)N1C2=CC=CC=C2N=C1S(=O)C3CCCCC4=C(C=CN=C34)OC

InChI

InChI=1S/C22H25N3O5S/c1-28-13-14-30-22(26)25-17-9-5-4-8-16(17)24-21(25)31(27)19-10-6-3-7-15-18(29-2)11-12-23-20(15)19/h4-5,8-9,11-12,19H,3,6-7,10,13-14H2,1-2H3