2-[4,6-bis(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4,6-bis(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[4,6-bis(4-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]acetamide CAS Name: 2-[[4,6-bis(4-chlorophenyl)-3-cyano-2-pyridinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4,6-bis(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[4,6-bis(4-chlorophenyl)-3-cyano-2-pyridyl]thio]acetamide Formula: C27H19Cl2N3OS MolecularWeight: 504.43026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C27H19Cl2N3OS/c28-21-10-6-19(7-11-21)23-14-25(20-8-12-22(29)13-9-20)32-27(24(23)15-30)34-17-26(33)31-16-18-4-2-1-3-5-18/h1-14H,16-17H2,(H,31,33)