2-(2-hydroxyethylamino)-4-phenyl-6-(phenylmethylsulfanyl)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-(2-hydroxyethylamino)-4-phenyl-6-(phenylmethylsulfanyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-benzylsulfanyl-6-(2-hydroxyethylamino)-4-phenyl-pyridine-3,5-dicarbonitrile CAS Name: 2-(2-hydroxyethylamino)-4-phenyl-6-(phenylmethylthio)pyridine-3,5-dicarbonitrile IUPAC Name: 2-benzylsulfanyl-6-(2-hydroxyethylamino)-4-phenylpyridine-3,5-dicarbonitrile Traditional Name: 2-(benzylthio)-6-(2-hydroxyethylamino)-4-phenyl-dinicotinonitrile Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=C(C(=N2)NCCO)C#N)C3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=C(C(=N2)NCCO)C#N)C3=CC=CC=C3)C#N

InChI

InChI=1S/C22H18N4OS/c23-13-18-20(17-9-5-2-6-10-17)19(14-24)22(26-21(18)25-11-12-27)28-15-16-7-3-1-4-8-16/h1-10,27H,11-12,15H2,(H,25,26)