4-butoxy-N-[2-(2-cyanoethylsulfanyl)phenyl]benzamide

Systemtic Name: 4-butoxy-N-[2-(2-cyanoethylsulfanyl)phenyl]benzamide Openeye Name: 4-butoxy-N-[2-(2-cyanoethylsulfanyl)phenyl]benzamide CAS Name: 4-butoxy-N-[2-(2-cyanoethylthio)phenyl]benzamide IUPAC Name: 4-butoxy-N-[2-(2-cyanoethylsulfanyl)phenyl]benzamide Traditional Name: 4-butoxy-N-[2-(2-cyanoethylthio)phenyl]benzamide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SCCC#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SCCC#N

InChI

InChI=1S/C20H22N2O2S/c1-2-3-14-24-17-11-9-16(10-12-17)20(23)22-18-7-4-5-8-19(18)25-15-6-13-21/h4-5,7-12H,2-3,6,14-15H2,1H3,(H,22,23)