5-(1,3-benzodioxol-5-yl)-6-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-1-methyl-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-6-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-1-methyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-(1,3-benzodioxol-5-yl)-6-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-1-methyl-2-oxo-pyridine-3-carbonitrile CAS Name: 5-(1,3-benzodioxol-5-yl)-6-[[(4-cyanophenyl)-(3-methyl-4-imidazolyl)methoxy]methyl]-1-methyl-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-(1,3-benzodioxol-5-yl)-6-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-1-methyl-2-oxopyridine-3-carbonitrile Traditional Name: 5-(1,3-benzodioxol-5-yl)-6-[[(4-cyanophenyl)-(3-methylimidazol-4-yl)methoxy]methyl]-2-keto-1-methyl-nicotinonitrile Formula: C27H21N5O4 MolecularWeight: 479.48674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)OCC3=C(C=C(C(=O)N3C)C#N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)OCC3=C(C=C(C(=O)N3C)C#N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H21N5O4/c1-31-15-30-13-22(31)26(18-5-3-17(11-28)4-6-18)34-14-23-21(9-20(12-29)27(33)32(23)2)19-7-8-24-25(10-19)36-16-35-24/h3-10,13,15,26H,14,16H2,1-2H3