2-azanyl-6-(2-hydroxyethylsulfanyl)-4-(4-phenylmethoxyphenyl)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-(2-hydroxyethylsulfanyl)-4-(4-phenylmethoxyphenyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-benzyloxyphenyl)-6-(2-hydroxyethylsulfanyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-(2-hydroxyethylthio)-4-(4-phenylmethoxyphenyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(2-hydroxyethylsulfanyl)-4-(4-phenylmethoxyphenyl)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-benzoxyphenyl)-6-(2-hydroxyethylthio)dinicotinonitrile Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C(=NC(=C3C#N)SCCO)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(C(=NC(=C3C#N)SCCO)N)C#N

InChI

InChI=1S/C22H18N4O2S/c23-12-18-20(19(13-24)22(26-21(18)25)29-11-10-27)16-6-8-17(9-7-16)28-14-15-4-2-1-3-5-15/h1-9,27H,10-11,14H2,(H2,25,26)