6-(2-methoxyphenyl)-2,2-dimethyl-4-(pentan-2-ylsulfanylmethyl)-1H-quinoline

Systemtic Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-(pentan-2-ylsulfanylmethyl)-1H-quinoline Openeye Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-(1-methylbutylsulfanylmethyl)-1H-quinoline CAS Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-[(pentan-2-ylthio)methyl]-1H-quinoline IUPAC Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-(pentan-2-ylsulfanylmethyl)-1H-quinoline Traditional Name: 6-(2-methoxyphenyl)-2,2-dimethyl-4-[(1-methylbutylthio)methyl]-1H-quinoline Formula: C24H31NOS MolecularWeight: 381.57404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)SCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C

Isomeric SMILES

CCCC(C)SCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C

InChI

InChI=1S/C24H31NOS/c1-6-9-17(2)27-16-19-15-24(3,4)25-22-13-12-18(14-21(19)22)20-10-7-8-11-23(20)26-5/h7-8,10-15,17,25H,6,9,16H2,1-5H3