3-[(4-methoxyphenyl)methyl]-2-methyl-6-(3-methylbutoxy)-1H-quinoline-4-thione

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-2-methyl-6-(3-methylbutoxy)-1H-quinoline-4-thione Openeye Name: 6-isopentyloxy-3-[(4-methoxyphenyl)methyl]-2-methyl-1H-quinoline-4-thione CAS Name: 3-[(4-methoxyphenyl)methyl]-2-methyl-6-(3-methylbutoxy)-1H-quinoline-4-thione IUPAC Name: 3-[(4-methoxyphenyl)methyl]-2-methyl-6-(3-methylbutoxy)-1H-quinoline-4-thione Traditional Name: 6-isoamoxy-2-methyl-3-p-anisyl-1H-quinoline-4-thione Formula: C23H27NO2S MolecularWeight: 381.53098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)C2=C(N1)C=CC(=C2)OCCC(C)C)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=S)C2=C(N1)C=CC(=C2)OCCC(C)C)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H27NO2S/c1-15(2)11-12-26-19-9-10-22-21(14-19)23(27)20(16(3)24-22)13-17-5-7-18(25-4)8-6-17/h5-10,14-15H,11-13H2,1-4H3,(H,24,27)