2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(5-phenylfuran-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(5-phenylfuran-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-4-(5-phenyl-2-furyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-4-(5-phenyl-2-furanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-4-(5-phenylfuran-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-4-(5-phenyl-2-furyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C28H21ClN2O2S MolecularWeight: 484.99654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)C#N)C4=CC=C(O4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)SCC(=O)C3=CC=C(C=C3)Cl)C#N)C4=CC=C(O4)C5=CC=CC=C5

InChI

InChI=1S/C28H21ClN2O2S/c29-20-12-10-18(11-13-20)24(32)17-34-28-22(16-30)27(21-8-4-5-9-23(21)31-28)26-15-14-25(33-26)19-6-2-1-3-7-19/h1-3,6-7,10-15H,4-5,8-9,17H2