2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(2-chloranylpyridin-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanyl-5-ethyl-thiophen-2-yl)-1-(2-chloranylpyridin-3-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(2-chloro-3-pyridyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-ethyl-2-thiophenyl)-1-(2-chloro-3-pyridinyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-1-(2-chloropyridin-3-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-ethyl-2-thienyl)-1-(2-chloro-3-pyridyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H18BrClN4OS MolecularWeight: 489.81582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(N=CC=C4)Cl)N)C#N)Br

Isomeric SMILES

CCC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(N=CC=C4)Cl)N)C#N)Br

InChI

InChI=1S/C21H18BrClN4OS/c1-2-16-12(22)9-17(29-16)18-11(10-24)21(25)27(14-6-4-8-26-20(14)23)13-5-3-7-15(28)19(13)18/h4,6,8-9,18H,2-3,5,7,25H2,1H3