N-(3,4-dimethoxyphenyl)-3-(pyridin-2-ylmethylsulfanyl)propanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-3-(pyridin-2-ylmethylsulfanyl)propanamide Openeye Name: N-(3,4-dimethoxyphenyl)-3-(2-pyridylmethylsulfanyl)propanamide CAS Name: N-(3,4-dimethoxyphenyl)-3-(2-pyridinylmethylthio)propanamide IUPAC Name: N-(3,4-dimethoxyphenyl)-3-(pyridin-2-ylmethylsulfanyl)propanamide Traditional Name: N-(3,4-dimethoxyphenyl)-3-(2-pyridylmethylthio)propionamide Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCSCC2=CC=CC=N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCSCC2=CC=CC=N2)OC

InChI

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