butyl 6-(5-cyanothiophen-2-yl)-2,2,4-trimethyl-quinoline-1-carboxylate

Systemtic Name: butyl 6-(5-cyanothiophen-2-yl)-2,2,4-trimethyl-quinoline-1-carboxylate Openeye Name: butyl 6-(5-cyano-2-thienyl)-2,2,4-trimethyl-quinoline-1-carboxylate CAS Name: 6-(5-cyano-2-thiophenyl)-2,2,4-trimethyl-1-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 6-(5-cyanothiophen-2-yl)-2,2,4-trimethylquinoline-1-carboxylate Traditional Name: 6-(5-cyano-2-thienyl)-2,2,4-trimethyl-quinoline-1-carboxylic acid butyl ester Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1C2=C(C=C(C=C2)C3=CC=C(S3)C#N)C(=CC1(C)C)C

Isomeric SMILES

CCCCOC(=O)N1C2=C(C=C(C=C2)C3=CC=C(S3)C#N)C(=CC1(C)C)C

InChI

InChI=1S/C22H24N2O2S/c1-5-6-11-26-21(25)24-19-9-7-16(20-10-8-17(14-23)27-20)12-18(19)15(2)13-22(24,3)4/h7-10,12-13H,5-6,11H2,1-4H3