4-[[5-[[4-(3-chlorophenyl)-1-methyl-2-oxidanylidene-5,7,8,8a-tetrahydro-4aH-1,6-naphthyridin-6-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[4-(3-chlorophenyl)-1-methyl-2-oxidanylidene-5,7,8,8a-tetrahydro-4aH-1,6-naphthyridin-6-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[4-(3-chlorophenyl)-1-methyl-2-oxo-5,7,8,8a-tetrahydro-4aH-1,6-naphthyridin-6-yl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[4-(3-chlorophenyl)-1-methyl-2-oxo-5,7,8,8a-tetrahydro-4aH-1,6-naphthyridin-6-yl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[4-(3-chlorophenyl)-1-methyl-2-oxo-5,7,8,8a-tetrahydro-4aH-1,6-naphthyridin-6-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[4-(3-chlorophenyl)-2-keto-1-methyl-5,7,8,8a-tetrahydro-4aH-1,6-naphthyridin-6-yl]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C27H26ClN5O MolecularWeight: 471.98124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCN(CC2C(=CC1=O)C3=CC(=CC=C3)Cl)CC4=CN=CN4CC5=CC=C(C=C5)C#N

Isomeric SMILES

CN1C2CCN(CC2C(=CC1=O)C3=CC(=CC=C3)Cl)CC4=CN=CN4CC5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H26ClN5O/c1-31-26-9-10-32(17-25(26)24(12-27(31)34)21-3-2-4-22(28)11-21)16-23-14-30-18-33(23)15-20-7-5-19(13-29)6-8-20/h2-8,11-12,14,18,25-26H,9-10,15-17H2,1H3