N-(3-chloranyl-4-methoxy-phenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-[2-(2-pyridyl)ethylsulfanyl]propanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-[2-(2-pyridinyl)ethylthio]propanamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-(2-pyridin-2-ylethylsulfanyl)propanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-[2-(2-pyridyl)ethylthio]propionamide Formula: C17H19ClN2O2S MolecularWeight: 350.86296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCSCCC2=CC=CC=N2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCSCCC2=CC=CC=N2)Cl

InChI

InChI=1S/C17H19ClN2O2S/c1-22-16-6-5-14(12-15(16)18)20-17(21)8-11-23-10-7-13-4-2-3-9-19-13/h2-6,9,12H,7-8,10-11H2,1H3,(H,20,21)