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

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)benzamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-(4-pyridylmethylsulfanyl)benzamide CAS Name: N-(3,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylthio)benzamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)benzamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-(4-pyridylmethylthio)benzamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=NC=C3)OC

InChI

InChI=1S/C21H20N2O3S/c1-25-18-8-7-16(13-19(18)26-2)23-21(24)17-5-3-4-6-20(17)27-14-15-9-11-22-12-10-15/h3-13H,14H2,1-2H3,(H,23,24)