N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(1,3-dithiolan-2-yl)benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-(1,3-dithiolan-2-yl)benzamide Formula: C20H20N2OS3 MolecularWeight: 400.5806

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H20N2OS3/c21-13-17-3-1-2-4-18(17)14-24-10-9-22-19(23)15-5-7-16(8-6-15)20-25-11-12-26-20/h1-8,20H,9-12,14H2,(H,22,23)