1-(4-methylsulfonylphenyl)-1-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-(4-methylsulfonylphenyl)-1-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methyl]-3-propan-2-yl-urea Openeye Name: 3-isopropyl-1-[[3-[6-(1-methyl-1-methylsulfonyl-ethyl)-8-quinolyl]phenyl]methyl]-1-(4-methylsulfonylphenyl)urea CAS Name: 1-(4-methylsulfonylphenyl)-1-[[3-[6-(2-methylsulfonylpropan-2-yl)-8-quinolinyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-(4-methylsulfonylphenyl)-1-[[3-[6-(2-methylsulfonylpropan-2-yl)quinolin-8-yl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 3-isopropyl-1-[3-[6-(1-mesyl-1-methyl-ethyl)-8-quinolyl]benzyl]-1-(4-mesylphenyl)urea Formula: C31H35N3O5S2 MolecularWeight: 593.7567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N(CC1=CC=CC(=C1)C2=C3C(=CC(=C2)C(C)(C)S(=O)(=O)C)C=CC=N3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC(C)NC(=O)N(CC1=CC=CC(=C1)C2=C3C(=CC(=C2)C(C)(C)S(=O)(=O)C)C=CC=N3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C31H35N3O5S2/c1-21(2)33-30(35)34(26-12-14-27(15-13-26)40(5,36)37)20-22-9-7-10-23(17-22)28-19-25(31(3,4)41(6,38)39)18-24-11-8-16-32-29(24)28/h7-19,21H,20H2,1-6H3,(H,33,35)