2-azanyl-4-(3,4-dimethylphenyl)-6-(furan-2-ylmethylsulfanyl)pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(3,4-dimethylphenyl)-6-(furan-2-ylmethylsulfanyl)pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(3,4-dimethylphenyl)-6-(2-furylmethylsulfanyl)pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(3,4-dimethylphenyl)-6-(2-furanylmethylthio)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(3,4-dimethylphenyl)-6-(furan-2-ylmethylsulfanyl)pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(3,4-dimethylphenyl)-6-(2-furfurylthio)dinicotinonitrile Formula: C20H16N4OS MolecularWeight: 360.43224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=NC(=C2C#N)SCC3=CC=CO3)N)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=NC(=C2C#N)SCC3=CC=CO3)N)C#N)C

InChI

InChI=1S/C20H16N4OS/c1-12-5-6-14(8-13(12)2)18-16(9-21)19(23)24-20(17(18)10-22)26-11-15-4-3-7-25-15/h3-8H,11H2,1-2H3,(H2,23,24)