4-[[4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxidanylidene-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxidanylidene-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(3-methylimidazol-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[[4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxo-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile CAS Name: 4-[[4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxo-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(3-methyl-4-imidazolyl)methyl]benzonitrile IUPAC Name: 4-[[4-(1,3-benzodioxol-5-yl)-1-methyl-2-oxo-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile Traditional Name: 4-[[4-(1,3-benzodioxol-5-yl)-2-keto-1-methyl-7,8-dihydro-5H-1,6-naphthyridin-6-yl]-(3-methylimidazol-4-yl)methyl]benzonitrile Formula: C28H25N5O3 MolecularWeight: 479.5298

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)N3CCC4=C(C3)C(=CC(=O)N4C)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)C#N)N3CCC4=C(C3)C(=CC(=O)N4C)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H25N5O3/c1-31-16-30-14-24(31)28(19-5-3-18(13-29)4-6-19)33-10-9-23-22(15-33)21(12-27(34)32(23)2)20-7-8-25-26(11-20)36-17-35-25/h3-8,11-12,14,16,28H,9-10,15,17H2,1-2H3