2-(4-methylsulfanyl-2-propoxy-phenyl)-1,4-dihydroimidazo[4,5-b]pyridin-5-one hydrochloride

Systemtic Name: 2-(4-methylsulfanyl-2-propoxy-phenyl)-1,4-dihydroimidazo[4,5-b]pyridin-5-one hydrochloride Openeye Name: 2-(4-methylsulfanyl-2-propoxy-phenyl)-1,4-dihydroimidazo[4,5-b]pyridin-5-one hydrochloride CAS Name: 2-[4-(methylthio)-2-propoxyphenyl]-1,4-dihydroimidazo[4,5-b]pyridin-5-one hydrochloride IUPAC Name: 2-(4-methylsulfanyl-2-propoxyphenyl)-1,4-dihydroimidazo[4,5-b]pyridin-5-one hydrochloride Traditional Name: 2-[4-(methylthio)-2-propoxy-phenyl]-1,4-dihydroimidazo[4,5-b]pyridin-5-one hydrochloride Formula: C16H18ClN3O2S MolecularWeight: 351.85102

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)SC)C2=NC3=C(N2)C=CC(=O)N3.Cl

Isomeric SMILES

CCCOC1=C(C=CC(=C1)SC)C2=NC3=C(N2)C=CC(=O)N3.Cl

InChI

InChI=1S/C16H17N3O2S.ClH/c1-3-8-21-13-9-10(22-2)4-5-11(13)15-17-12-6-7-14(20)18-16(12)19-15;/h4-7,9H,3,8H2,1-2H3,(H2,17,18,19,20);1H