2-azanyl-4-(4-butoxyphenyl)-6-methylsulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-butoxyphenyl)-6-methylsulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-butoxyphenyl)-6-methylsulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(4-butoxyphenyl)-6-(methylthio)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(4-butoxyphenyl)-6-methylsulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-butoxyphenyl)-6-(methylthio)dinicotinonitrile Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC)N)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SC)N)C#N

InChI

InChI=1S/C18H18N4OS/c1-3-4-9-23-13-7-5-12(6-8-13)16-14(10-19)17(21)22-18(24-2)15(16)11-20/h5-8H,3-4,9H2,1-2H3,(H2,21,22)