3-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-2-(1H-pyrrol-2-yl)-1,3-thiazolidin-4-one

Systemtic Name: 3-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-2-(1H-pyrrol-2-yl)-1,3-thiazolidin-4-one Openeye Name: 3-[2-(4-hydroxy-3-methoxy-phenyl)ethyl]-2-(1H-pyrrol-2-yl)thiazolidin-4-one CAS Name: 3-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-2-(1H-pyrrol-2-yl)-4-thiazolidinone IUPAC Name: 3-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-2-(1H-pyrrol-2-yl)-1,3-thiazolidin-4-one Traditional Name: 3-homovanillyl-2-(1H-pyrrol-2-yl)thiazolidin-4-one Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCN2C(SCC2=O)C3=CC=CN3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCN2C(SCC2=O)C3=CC=CN3)O

InChI

InChI=1S/C16H18N2O3S/c1-21-14-9-11(4-5-13(14)19)6-8-18-15(20)10-22-16(18)12-3-2-7-17-12/h2-5,7,9,16-17,19H,6,8,10H2,1H3