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

Systemtic Name: 2-azanyl-1-(5-bromanylpyridin-2-yl)-4-(4-ethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(5-bromo-2-pyridyl)-4-(4-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(5-bromo-2-pyridinyl)-4-(4-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(5-bromopyridin-2-yl)-4-(4-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(5-bromo-2-pyridyl)-4-(4-ethylphenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H21BrN4O MolecularWeight: 449.34304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NC=C(C=C4)Br)N)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NC=C(C=C4)Br)N)C#N

InChI

InChI=1S/C23H21BrN4O/c1-2-14-6-8-15(9-7-14)21-17(12-25)23(26)28(20-11-10-16(24)13-27-20)18-4-3-5-19(29)22(18)21/h6-11,13,21H,2-5,26H2,1H3