2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C24H19BrN2OS MolecularWeight: 463.38946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Br)C#N)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Br)C#N)C4=CC=CC=C4

InChI

InChI=1S/C24H19BrN2OS/c25-18-12-10-16(11-13-18)22(28)15-29-24-20(14-26)23(17-6-2-1-3-7-17)19-8-4-5-9-21(19)27-24/h1-3,6-7,10-13H,4-5,8-9,15H2