N-phenethyl-2-prop-2-enylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-phenethyl-2-prop-2-enylsulfanyl-pyridine-3-carboxamide Openeye Name: 2-allylsulfanyl-N-phenethyl-pyridine-3-carboxamide CAS Name: N-phenethyl-2-(prop-2-enylthio)-3-pyridinecarboxamide IUPAC Name: N-phenethyl-2-prop-2-enylsulfanylpyridine-3-carboxamide Traditional Name: 2-(allylthio)-N-phenethyl-nicotinamide Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C=CC=N1)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C17H18N2OS/c1-2-13-21-17-15(9-6-11-19-17)16(20)18-12-10-14-7-4-3-5-8-14/h2-9,11H,1,10,12-13H2,(H,18,20)