N-(3-chlorophenyl)-3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-chlorophenyl)-3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-chlorophenyl)-3-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]propanamide CAS Name: N-(3-chlorophenyl)-3-[(3-cyano-6-phenyl-2-pyridinyl)thio]propanamide IUPAC Name: N-(3-chlorophenyl)-3-(3-cyano-6-phenylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-(3-chlorophenyl)-3-[(3-cyano-6-phenyl-2-pyridyl)thio]propionamide Formula: C21H16ClN3OS MolecularWeight: 393.88924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCCC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SCCC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H16ClN3OS/c22-17-7-4-8-18(13-17)24-20(26)11-12-27-21-16(14-23)9-10-19(25-21)15-5-2-1-3-6-15/h1-10,13H,11-12H2,(H,24,26)