4-[2,3-bis(chloranyl)phenyl]-2-butylsulfanyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile

Systemtic Name: 4-[2,3-bis(chloranyl)phenyl]-2-butylsulfanyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Openeye Name: 2-butylsulfanyl-4-(2,3-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile CAS Name: 2-(butylthio)-4-(2,3-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile IUPAC Name: 2-butylsulfanyl-4-(2,3-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Traditional Name: 2-(butylthio)-4-(2,3-dichlorophenyl)-5-keto-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile Formula: C20H20Cl2N2OS MolecularWeight: 407.3566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)Cl)Cl)C#N

Isomeric SMILES

CCCCSC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)Cl)Cl)C#N

InChI

InChI=1S/C20H20Cl2N2OS/c1-2-3-10-26-20-13(11-23)17(12-6-4-7-14(21)19(12)22)18-15(24-20)8-5-9-16(18)25/h4,6-7,17,24H,2-3,5,8-10H2,1H3