2-azanyl-1-(5-bromanylpyridin-2-yl)-4-(3,4-dimethoxyphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(5-bromanylpyridin-2-yl)-4-(3,4-dimethoxyphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(5-bromo-2-pyridyl)-4-(3,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(5-bromo-2-pyridinyl)-4-(3,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(5-bromopyridin-2-yl)-4-(3,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(5-bromo-2-pyridyl)-4-(3,4-dimethoxyphenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H21BrN4O3 MolecularWeight: 481.34184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NC=C(C=C4)Br)N)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NC=C(C=C4)Br)N)C#N)OC

InChI

InChI=1S/C23H21BrN4O3/c1-30-18-8-6-13(10-19(18)31-2)21-15(11-25)23(26)28(20-9-7-14(24)12-27-20)16-4-3-5-17(29)22(16)21/h6-10,12,21H,3-5,26H2,1-2H3