4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-propylsulfanyl-1,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-propylsulfanyl-1,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-2-propylsulfanyl-1,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: 4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-2-(propylthio)-1,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-2-propylsulfanyl-1,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 4-(3,4-dimethoxyphenyl)-5-keto-7,7-dimethyl-2-(propylthio)-1,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OC)OC)C#N

Isomeric SMILES

CCCSC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OC)OC)C#N

InChI

InChI=1S/C23H28N2O3S/c1-6-9-29-22-15(13-24)20(14-7-8-18(27-4)19(10-14)28-5)21-16(25-22)11-23(2,3)12-17(21)26/h7-8,10,20,25H,6,9,11-12H2,1-5H3