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

Systemtic Name: 2,2-dimethyl-4-(phenethylsulfanylmethyl)-6-(2-phenylphenyl)-1H-quinoline Openeye Name: 2,2-dimethyl-4-(phenethylsulfanylmethyl)-6-(2-phenylphenyl)-1H-quinoline CAS Name: 2,2-dimethyl-4-[(phenethylthio)methyl]-6-(2-phenylphenyl)-1H-quinoline IUPAC Name: 2,2-dimethyl-4-(phenethylsulfanylmethyl)-6-(2-phenylphenyl)-1H-quinoline Traditional Name: 2,2-dimethyl-4-[(phenethylthio)methyl]-6-(2-phenylphenyl)-1H-quinoline Formula: C32H31NS MolecularWeight: 461.66024

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(N1)C=CC(=C2)C3=CC=CC=C3C4=CC=CC=C4)CSCCC5=CC=CC=C5)C

Isomeric SMILES

CC1(C=C(C2=C(N1)C=CC(=C2)C3=CC=CC=C3C4=CC=CC=C4)CSCCC5=CC=CC=C5)C

InChI

InChI=1S/C32H31NS/c1-32(2)22-27(23-34-20-19-24-11-5-3-6-12-24)30-21-26(17-18-31(30)33-32)29-16-10-9-15-28(29)25-13-7-4-8-14-25/h3-18,21-22,33H,19-20,23H2,1-2H3