2-azanyl-4-(4-chlorophenyl)-6-phenacylsulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-chlorophenyl)-6-phenacylsulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-chlorophenyl)-6-phenacylsulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(4-chlorophenyl)-6-(phenacylthio)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(4-chlorophenyl)-6-phenacylsulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-chlorophenyl)-6-(phenacylthio)dinicotinonitrile Formula: C21H13ClN4OS MolecularWeight: 404.87212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13ClN4OS/c22-15-8-6-14(7-9-15)19-16(10-23)20(25)26-21(17(19)11-24)28-12-18(27)13-4-2-1-3-5-13/h1-9H,12H2,(H2,25,26)