7,7-dimethyl-5-oxidanylidene-4-phenyl-3-prop-2-enyl-2-sulfanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 7,7-dimethyl-5-oxidanylidene-4-phenyl-3-prop-2-enyl-2-sulfanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 3-allyl-7,7-dimethyl-5-oxo-4-phenyl-2-thioxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: 7,7-dimethyl-5-oxo-4-phenyl-3-prop-2-enyl-2-sulfanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 7,7-dimethyl-5-oxo-4-phenyl-3-prop-2-enyl-2-sulfanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 3-allyl-5-keto-7,7-dimethyl-4-phenyl-2-thioxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C21H22N2OS MolecularWeight: 350.47718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(C(=S)N2)(CC=C)C#N)C3=CC=CC=C3)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(C(=S)N2)(CC=C)C#N)C3=CC=CC=C3)C(=O)C1)C

InChI

InChI=1S/C21H22N2OS/c1-4-10-21(13-22)18(14-8-6-5-7-9-14)17-15(23-19(21)25)11-20(2,3)12-16(17)24/h4-9,18H,1,10-12H2,2-3H3,(H,23,25)