N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-6-methyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-homoveratryl-6-methyl-2-(2-thienyl)cinchoninamide Formula: C25H24N2O3S MolecularWeight: 432.53466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC3=CC(=C(C=C3)OC)OC)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC3=CC(=C(C=C3)OC)OC)C4=CC=CS4

InChI

InChI=1S/C25H24N2O3S/c1-16-6-8-20-18(13-16)19(15-21(27-20)24-5-4-12-31-24)25(28)26-11-10-17-7-9-22(29-2)23(14-17)30-3/h4-9,12-15H,10-11H2,1-3H3,(H,26,28)