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

Systemtic Name: 2-(2-hydroxyethylamino)-4-[4-(2-hydroxyethyloxy)phenyl]-6-(phenylmethylsulfanyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-benzylsulfanyl-4-[4-(2-hydroxyethoxy)phenyl]-6-(2-hydroxyethylamino)pyridine-3,5-dicarbonitrile CAS Name: 4-[4-(2-hydroxyethoxy)phenyl]-2-(2-hydroxyethylamino)-6-(phenylmethylthio)pyridine-3,5-dicarbonitrile IUPAC Name: 2-benzylsulfanyl-4-[4-(2-hydroxyethoxy)phenyl]-6-(2-hydroxyethylamino)pyridine-3,5-dicarbonitrile Traditional Name: 2-(benzylthio)-4-[4-(2-hydroxyethoxy)phenyl]-6-(2-hydroxyethylamino)dinicotinonitrile Formula: C24H22N4O3S MolecularWeight: 446.52148

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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=C(C=C3)OCCO)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H22N4O3S/c25-14-20-22(18-6-8-19(9-7-18)31-13-12-30)21(15-26)24(28-23(20)27-10-11-29)32-16-17-4-2-1-3-5-17/h1-9,29-30H,10-13,16H2,(H,27,28)