[4-[[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]amino]phenyl] thiocyanate

Systemtic Name: [4-[[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]amino]phenyl] thiocyanate Openeye Name: [4-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[3-cyano-6-(4-methoxyphenyl)-2-pyridinyl]amino]phenyl] ester IUPAC Name: [4-[[3-cyano-6-(4-methoxyphenyl)pyridin-2-yl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[[3-cyano-6-(4-methoxyphenyl)-2-pyridyl]amino]phenyl] ester Formula: C20H14N4OS MolecularWeight: 358.41636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)NC3=CC=C(C=C3)SC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)NC3=CC=C(C=C3)SC#N

InChI

InChI=1S/C20H14N4OS/c1-25-17-7-2-14(3-8-17)19-11-4-15(12-21)20(24-19)23-16-5-9-18(10-6-16)26-13-22/h2-11H,1H3,(H,23,24)