2-azanyl-1-(4-ethylphenyl)-4-(2-ethylsulfanylthiophen-3-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(4-ethylphenyl)-4-(2-ethylsulfanylthiophen-3-yl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-1-(4-ethylphenyl)-4-(2-ethylsulfanyl-3-thienyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-1-(4-ethylphenyl)-4-[2-(ethylthio)-3-thiophenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-1-(4-ethylphenyl)-4-(2-ethylsulfanylthiophen-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-1-(4-ethylphenyl)-4-[2-(ethylthio)-3-thienyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H29N3OS2 MolecularWeight: 463.65796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=C(SC=C4)SCC)C(=O)CC(C3)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C3=C(C(C(=C2N)C#N)C4=C(SC=C4)SCC)C(=O)CC(C3)(C)C

InChI

InChI=1S/C26H29N3OS2/c1-5-16-7-9-17(10-8-16)29-20-13-26(3,4)14-21(30)23(20)22(19(15-27)24(29)28)18-11-12-32-25(18)31-6-2/h7-12,22H,5-6,13-14,28H2,1-4H3