2-[(3-cyanophenyl)methylsulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(3-cyanophenyl)methylthio]-N-phenethylacetamide IUPAC Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-phenethylacetamide Traditional Name: 2-[(3-cyanobenzyl)thio]-N-phenethyl-acetamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSCC2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C18H18N2OS/c19-12-16-7-4-8-17(11-16)13-22-14-18(21)20-10-9-15-5-2-1-3-6-15/h1-8,11H,9-10,13-14H2,(H,20,21)