3-[(2,3-dimethoxyphenyl)methyl]-2-(1H-pyrrol-2-yl)-1,3-thiazinan-4-one

Systemtic Name: 3-[(2,3-dimethoxyphenyl)methyl]-2-(1H-pyrrol-2-yl)-1,3-thiazinan-4-one Openeye Name: 3-[(2,3-dimethoxyphenyl)methyl]-2-(1H-pyrrol-2-yl)-1,3-thiazinan-4-one CAS Name: 3-[(2,3-dimethoxyphenyl)methyl]-2-(1H-pyrrol-2-yl)-1,3-thiazinan-4-one IUPAC Name: 3-[(2,3-dimethoxyphenyl)methyl]-2-(1H-pyrrol-2-yl)-1,3-thiazinan-4-one Traditional Name: 3-o-veratryl-2-(1H-pyrrol-2-yl)-1,3-thiazinan-4-one Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2C(SCCC2=O)C3=CC=CN3

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2C(SCCC2=O)C3=CC=CN3

InChI

InChI=1S/C17H20N2O3S/c1-21-14-7-3-5-12(16(14)22-2)11-19-15(20)8-10-23-17(19)13-6-4-9-18-13/h3-7,9,17-18H,8,10-11H2,1-2H3