1-(2-methylquinolin-4-yl)-3-[2-[4-[(4-pentylphenyl)sulfonylamino]piperidin-1-yl]ethyl]urea

Systemtic Name: 1-(2-methylquinolin-4-yl)-3-[2-[4-[(4-pentylphenyl)sulfonylamino]piperidin-1-yl]ethyl]urea Openeye Name: 1-(2-methyl-4-quinolyl)-3-[2-[4-[(4-pentylphenyl)sulfonylamino]-1-piperidyl]ethyl]urea CAS Name: 1-(2-methyl-4-quinolinyl)-3-[2-[4-[(4-pentylphenyl)sulfonylamino]-1-piperidinyl]ethyl]urea IUPAC Name: 1-(2-methylquinolin-4-yl)-3-[2-[4-[(4-pentylphenyl)sulfonylamino]piperidin-1-yl]ethyl]urea Traditional Name: 1-[2-[4-[(4-amylphenyl)sulfonylamino]piperidino]ethyl]-3-(2-methyl-4-quinolyl)urea Formula: C29H39N5O3S MolecularWeight: 537.71666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(CC2)CCNC(=O)NC3=CC(=NC4=CC=CC=C43)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(CC2)CCNC(=O)NC3=CC(=NC4=CC=CC=C43)C

InChI

InChI=1S/C29H39N5O3S/c1-3-4-5-8-23-11-13-25(14-12-23)38(36,37)33-24-15-18-34(19-16-24)20-17-30-29(35)32-28-21-22(2)31-27-10-7-6-9-26(27)28/h6-7,9-14,21,24,33H,3-5,8,15-20H2,1-2H3,(H2,30,31,32,35)