2-azanyl-4-(4-bromanyl-5-methyl-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-methyl-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-methyl-2-thienyl)-1-(2-chloro-3-pyridyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-methyl-2-thiophenyl)-1-(2-chloro-3-pyridinyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-methylthiophen-2-yl)-1-(2-chloropyridin-3-yl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-methyl-2-thienyl)-1-(2-chloro-3-pyridyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C20H16BrClN4OS MolecularWeight: 475.78924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(N=CC=C4)Cl)N)C#N)Br

Isomeric SMILES

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=C(N=CC=C4)Cl)N)C#N)Br

InChI

InChI=1S/C20H16BrClN4OS/c1-10-12(21)8-16(28-10)17-11(9-23)20(24)26(14-5-3-7-25-19(14)22)13-4-2-6-15(27)18(13)17/h3,5,7-8,17H,2,4,6,24H2,1H3