2-[(4-cyanophenyl)methylsulfanyl]-N-[5-[(3-cyanophenyl)methyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[5-[(3-cyanophenyl)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[5-[(3-cyanophenyl)methyl]thiazol-2-yl]acetamide CAS Name: N-[5-[(3-cyanophenyl)methyl]-2-thiazolyl]-2-[(4-cyanophenyl)methylthio]acetamide IUPAC Name: 2-[(4-cyanophenyl)methylsulfanyl]-N-[5-[(3-cyanophenyl)methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-[5-(3-cyanobenzyl)thiazol-2-yl]-2-[(4-cyanobenzyl)thio]acetamide Formula: C21H16N4OS2 MolecularWeight: 404.50794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC2=CN=C(S2)NC(=O)CSCC3=CC=C(C=C3)C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CC2=CN=C(S2)NC(=O)CSCC3=CC=C(C=C3)C#N)C#N

InChI

InChI=1S/C21H16N4OS2/c22-10-15-4-6-16(7-5-15)13-27-14-20(26)25-21-24-12-19(28-21)9-17-2-1-3-18(8-17)11-23/h1-8,12H,9,13-14H2,(H,24,25,26)