2-(1H-imidazol-2-ylmethylsulfanyl)-6-(2-methoxyethylamino)-4-phenyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-(1H-imidazol-2-ylmethylsulfanyl)-6-(2-methoxyethylamino)-4-phenyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-(1H-imidazol-2-ylmethylsulfanyl)-6-(2-methoxyethylamino)-4-phenyl-pyridine-3,5-dicarbonitrile CAS Name: 2-(1H-imidazol-2-ylmethylthio)-6-(2-methoxyethylamino)-4-phenylpyridine-3,5-dicarbonitrile IUPAC Name: 2-(1H-imidazol-2-ylmethylsulfanyl)-6-(2-methoxyethylamino)-4-phenylpyridine-3,5-dicarbonitrile Traditional Name: 2-(1H-imidazol-2-ylmethylthio)-6-(2-methoxyethylamino)-4-phenyl-dinicotinonitrile Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=C(C(=C1C#N)C2=CC=CC=C2)C#N)SCC3=NC=CN3

Isomeric SMILES

COCCNC1=NC(=C(C(=C1C#N)C2=CC=CC=C2)C#N)SCC3=NC=CN3

InChI

InChI=1S/C20H18N6OS/c1-27-10-9-25-19-15(11-21)18(14-5-3-2-4-6-14)16(12-22)20(26-19)28-13-17-23-7-8-24-17/h2-8H,9-10,13H2,1H3,(H,23,24)(H,25,26)