N-[1-[2-chloranyl-5-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]ethyl]-4-methylsulfanyl-aniline

Systemtic Name: N-[1-[2-chloranyl-5-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]ethyl]-4-methylsulfanyl-aniline Openeye Name: N-[1-[2-chloro-5-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]ethyl]-4-methylsulfanyl-aniline CAS Name: N-[1-[2-chloro-5-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]ethyl]-4-(methylthio)aniline IUPAC Name: N-[1-[2-chloro-5-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]ethyl]-4-methylsulfanylaniline Traditional Name: 1-[2-chloro-5-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]phenyl]ethyl-[4-(methylthio)phenyl]amine Formula: C28H29ClN2O2S2 MolecularWeight: 525.12506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)C2=C3C(=CC(=C2)C(C)(C)S(=O)(=O)C)C=CC=N3)Cl)NC4=CC=C(C=C4)SC

Isomeric SMILES

CC(C1=C(C=CC(=C1)C2=C3C(=CC(=C2)C(C)(C)S(=O)(=O)C)C=CC=N3)Cl)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C28H29ClN2O2S2/c1-18(31-22-9-11-23(34-4)12-10-22)24-16-19(8-13-26(24)29)25-17-21(28(2,3)35(5,32)33)15-20-7-6-14-30-27(20)25/h6-18,31H,1-5H3