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

Systemtic Name: 2-azanyl-6-(2-hydroxyethylsulfanyl)-4-(3-methoxyphenyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-(2-hydroxyethylsulfanyl)-4-(3-methoxyphenyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-(2-hydroxyethylthio)-4-(3-methoxyphenyl)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-(2-hydroxyethylsulfanyl)-4-(3-methoxyphenyl)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-(2-hydroxyethylthio)-4-(3-methoxyphenyl)dinicotinonitrile Formula: C16H14N4O2S MolecularWeight: 326.37296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=NC(=C2C#N)SCCO)N)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=NC(=C2C#N)SCCO)N)C#N

InChI

InChI=1S/C16H14N4O2S/c1-22-11-4-2-3-10(7-11)14-12(8-17)15(19)20-16(13(14)9-18)23-6-5-21/h2-4,7,21H,5-6H2,1H3,(H2,19,20)