1-[(2,5-dimethoxyphenyl)methoxy]-3-pyridin-2-ylsulfanyl-propan-2-ol hydrochloride

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methoxy]-3-pyridin-2-ylsulfanyl-propan-2-ol hydrochloride Openeye Name: 1-[(2,5-dimethoxyphenyl)methoxy]-3-(2-pyridylsulfanyl)propan-2-ol hydrochloride CAS Name: 1-[(2,5-dimethoxyphenyl)methoxy]-3-(2-pyridinylthio)-2-propanol hydrochloride IUPAC Name: 1-[(2,5-dimethoxyphenyl)methoxy]-3-pyridin-2-ylsulfanylpropan-2-ol hydrochloride Traditional Name: 1-(2,5-dimethoxybenzyl)oxy-3-(2-pyridylthio)propan-2-ol hydrochloride Formula: C17H22ClNO4S MolecularWeight: 371.87888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)COCC(CSC2=CC=CC=N2)O.Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)COCC(CSC2=CC=CC=N2)O.Cl

InChI

InChI=1S/C17H21NO4S.ClH/c1-20-15-6-7-16(21-2)13(9-15)10-22-11-14(19)12-23-17-5-3-4-8-18-17;/h3-9,14,19H,10-12H2,1-2H3;1H