2-azanyl-4-(5-butylthiophen-2-yl)-1-(2-ethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-butylthiophen-2-yl)-1-(2-ethylphenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(5-butyl-2-thienyl)-1-(2-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(5-butyl-2-thiophenyl)-1-(2-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(5-butylthiophen-2-yl)-1-(2-ethylphenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(5-butyl-2-thienyl)-1-(2-ethylphenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C26H29N3OS MolecularWeight: 431.59296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4CC)N)C#N

Isomeric SMILES

CCCCC1=CC=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4CC)N)C#N

InChI

InChI=1S/C26H29N3OS/c1-3-5-10-18-14-15-23(31-18)24-19(16-27)26(28)29(20-11-7-6-9-17(20)4-2)21-12-8-13-22(30)25(21)24/h6-7,9,11,14-15,24H,3-5,8,10,12-13,28H2,1-2H3