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

Systemtic Name: 6-(4-methoxyphenyl)-2,2-dimethyl-4-(phenethylsulfanylmethyl)-1H-quinoline Openeye Name: 6-(4-methoxyphenyl)-2,2-dimethyl-4-(phenethylsulfanylmethyl)-1H-quinoline CAS Name: 6-(4-methoxyphenyl)-2,2-dimethyl-4-[(phenethylthio)methyl]-1H-quinoline IUPAC Name: 6-(4-methoxyphenyl)-2,2-dimethyl-4-(phenethylsulfanylmethyl)-1H-quinoline Traditional Name: 6-(4-methoxyphenyl)-2,2-dimethyl-4-[(phenethylthio)methyl]-1H-quinoline Formula: C27H29NOS MolecularWeight: 415.59026

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(N1)C=CC(=C2)C3=CC=C(C=C3)OC)CSCCC4=CC=CC=C4)C

Isomeric SMILES

CC1(C=C(C2=C(N1)C=CC(=C2)C3=CC=C(C=C3)OC)CSCCC4=CC=CC=C4)C

InChI

InChI=1S/C27H29NOS/c1-27(2)18-23(19-30-16-15-20-7-5-4-6-8-20)25-17-22(11-14-26(25)28-27)21-9-12-24(29-3)13-10-21/h4-14,17-18,28H,15-16,19H2,1-3H3