5-[3-methoxy-4-(2-methyl-2-oxidanyl-propoxy)phenyl]-2-pyridin-4-yl-4H-thieno[2,3-c]pyrrol-6-one hydrochloride

Systemtic Name: 5-[3-methoxy-4-(2-methyl-2-oxidanyl-propoxy)phenyl]-2-pyridin-4-yl-4H-thieno[2,3-c]pyrrol-6-one hydrochloride Openeye Name: 5-[4-(2-hydroxy-2-methyl-propoxy)-3-methoxy-phenyl]-2-(4-pyridyl)-4H-thieno[2,3-c]pyrrol-6-one hydrochloride CAS Name: 5-[4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl]-2-pyridin-4-yl-4H-thieno[2,3-c]pyrrol-6-one hydrochloride IUPAC Name: 5-[4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl]-2-pyridin-4-yl-4H-thieno[2,3-c]pyrrol-6-one hydrochloride Traditional Name: 5-[4-(2-hydroxy-2-methyl-propoxy)-3-methoxy-phenyl]-2-(4-pyridyl)-4H-thieno[2,3-c]pyrrol-6-one hydrochloride Formula: C22H23ClN2O4S MolecularWeight: 446.94702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=C(C=C(C=C1)N2CC3=C(C2=O)SC(=C3)C4=CC=NC=C4)OC)O.Cl

Isomeric SMILES

CC(C)(COC1=C(C=C(C=C1)N2CC3=C(C2=O)SC(=C3)C4=CC=NC=C4)OC)O.Cl

InChI

InChI=1S/C22H22N2O4S.ClH/c1-22(2,26)13-28-17-5-4-16(11-18(17)27-3)24-12-15-10-19(29-20(15)21(24)25)14-6-8-23-9-7-14;/h4-11,26H,12-13H2,1-3H3;1H