2-azanyl-4-(3-phenylmethoxyphenyl)-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(3-phenylmethoxyphenyl)-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(3-benzyloxyphenyl)-6-phenylsulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(3-phenylmethoxyphenyl)-6-(phenylthio)pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(3-phenylmethoxyphenyl)-6-phenylsulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(3-benzoxyphenyl)-6-(phenylthio)dinicotinonitrile Formula: C26H18N4OS MolecularWeight: 434.51232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=C(C(=NC(=C3C#N)SC4=CC=CC=C4)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C3=C(C(=NC(=C3C#N)SC4=CC=CC=C4)N)C#N

InChI

InChI=1S/C26H18N4OS/c27-15-22-24(19-10-7-11-20(14-19)31-17-18-8-3-1-4-9-18)23(16-28)26(30-25(22)29)32-21-12-5-2-6-13-21/h1-14H,17H2,(H2,29,30)