2-azanyl-1-[2,3-bis(chloranyl)phenyl]-4-(5-bromanylthiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-[2,3-bis(chloranyl)phenyl]-4-(5-bromanylthiophen-2-yl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-thienyl)-1-(2,3-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-thiophenyl)-1-(2,3-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(5-bromothiophen-2-yl)-1-(2,3-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-thienyl)-1-(2,3-dichlorophenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C20H14BrCl2N3OS MolecularWeight: 495.21966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=C(C(=CC=C3)Cl)Cl)N)C#N)C4=CC=C(S4)Br)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2C3=C(C(=CC=C3)Cl)Cl)N)C#N)C4=CC=C(S4)Br)C(=O)C1

InChI

InChI=1S/C20H14BrCl2N3OS/c21-16-8-7-15(28-16)17-10(9-24)20(25)26(12-4-2-6-14(27)18(12)17)13-5-1-3-11(22)19(13)23/h1,3,5,7-8,17H,2,4,6,25H2