4-methylsulfonyl-N-[[3-(6-propan-2-ylquinolin-8-yl)phenyl]methyl]aniline

Systemtic Name: 4-methylsulfonyl-N-[[3-(6-propan-2-ylquinolin-8-yl)phenyl]methyl]aniline Openeye Name: N-[[3-(6-isopropyl-8-quinolyl)phenyl]methyl]-4-methylsulfonyl-aniline CAS Name: 4-methylsulfonyl-N-[[3-(6-propan-2-yl-8-quinolinyl)phenyl]methyl]aniline IUPAC Name: 4-methylsulfonyl-N-[[3-(6-propan-2-ylquinolin-8-yl)phenyl]methyl]aniline Traditional Name: [3-(6-isopropyl-8-quinolyl)benzyl]-(4-mesylphenyl)amine Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CNC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)CNC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C26H26N2O2S/c1-18(2)22-15-21-8-5-13-27-26(21)25(16-22)20-7-4-6-19(14-20)17-28-23-9-11-24(12-10-23)31(3,29)30/h4-16,18,28H,17H2,1-3H3