methyl 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-(6-oxidanylbenzimidazol-1-yl)thiophene-2-carboxylate

Systemtic Name: methyl 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-(6-oxidanylbenzimidazol-1-yl)thiophene-2-carboxylate Openeye Name: methyl 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-(6-hydroxybenzimidazol-1-yl)thiophene-2-carboxylate CAS Name: 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-(6-hydroxy-1-benzimidazolyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-(6-hydroxybenzimidazol-1-yl)thiophene-2-carboxylate Traditional Name: 3-[(1R)-1-(2-chlorophenyl)ethoxy]-5-(6-hydroxybenzimidazol-1-yl)thiophene-2-carboxylic acid methyl ester Formula: C21H17ClN2O4S MolecularWeight: 428.88868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC2=C(SC(=C2)N3C=NC4=C3C=C(C=C4)O)C(=O)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1Cl)OC2=C(SC(=C2)N3C=NC4=C3C=C(C=C4)O)C(=O)OC

InChI

InChI=1S/C21H17ClN2O4S/c1-12(14-5-3-4-6-15(14)22)28-18-10-19(29-20(18)21(26)27-2)24-11-23-16-8-7-13(25)9-17(16)24/h3-12,25H,1-2H3/t12-/m1/s1