4-(4-butoxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carbonitrile

Systemtic Name: 4-(4-butoxyphenyl)-7,7-dimethyl-5-oxidanylidene-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carbonitrile Openeye Name: 4-(4-butoxyphenyl)-7,7-dimethyl-5-oxo-2-thioxo-3,4,6,8-tetrahydro-1H-quinoline-3-carbonitrile CAS Name: 4-(4-butoxyphenyl)-7,7-dimethyl-5-oxo-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carbonitrile IUPAC Name: 4-(4-butoxyphenyl)-7,7-dimethyl-5-oxo-2-sulfanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carbonitrile Traditional Name: 4-(4-butoxyphenyl)-5-keto-7,7-dimethyl-2-thioxo-3,4,6,8-tetrahydro-1H-quinoline-3-carbonitrile Formula: C22H26N2O2S MolecularWeight: 382.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(C(=S)NC3=C2C(=O)CC(C3)(C)C)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(C(=S)NC3=C2C(=O)CC(C3)(C)C)C#N

InChI

InChI=1S/C22H26N2O2S/c1-4-5-10-26-15-8-6-14(7-9-15)19-16(13-23)21(27)24-17-11-22(2,3)12-18(25)20(17)19/h6-9,16,19H,4-5,10-12H2,1-3H3,(H,24,27)