N-[[3-(6-cyclopropylquinolin-8-yl)phenyl]methyl]-N-(4-methylsulfonylphenyl)butane-1-sulfonamide

Systemtic Name: N-[[3-(6-cyclopropylquinolin-8-yl)phenyl]methyl]-N-(4-methylsulfonylphenyl)butane-1-sulfonamide Openeye Name: N-[[3-(6-cyclopropyl-8-quinolyl)phenyl]methyl]-N-(4-methylsulfonylphenyl)butane-1-sulfonamide CAS Name: N-[[3-(6-cyclopropyl-8-quinolinyl)phenyl]methyl]-N-(4-methylsulfonylphenyl)-1-butanesulfonamide IUPAC Name: N-[[3-(6-cyclopropylquinolin-8-yl)phenyl]methyl]-N-(4-methylsulfonylphenyl)butane-1-sulfonamide Traditional Name: N-[3-(6-cyclopropyl-8-quinolyl)benzyl]-N-(4-mesylphenyl)butane-1-sulfonamide Formula: C30H32N2O4S2 MolecularWeight: 548.71608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N(CC1=CC=CC(=C1)C2=C3C(=CC(=C2)C4CC4)C=CC=N3)C5=CC=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CCCCS(=O)(=O)N(CC1=CC=CC(=C1)C2=C3C(=CC(=C2)C4CC4)C=CC=N3)C5=CC=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C30H32N2O4S2/c1-3-4-17-38(35,36)32(27-12-14-28(15-13-27)37(2,33)34)21-22-7-5-8-24(18-22)29-20-26(23-10-11-23)19-25-9-6-16-31-30(25)29/h5-9,12-16,18-20,23H,3-4,10-11,17,21H2,1-2H3