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

Systemtic Name: 1-(2-methylquinolin-4-yl)-3-[2-[3-[(4-pentylphenyl)sulfonylamino]pyrrolidin-1-yl]ethyl]urea Openeye Name: 1-(2-methyl-4-quinolyl)-3-[2-[3-[(4-pentylphenyl)sulfonylamino]pyrrolidin-1-yl]ethyl]urea CAS Name: 1-(2-methyl-4-quinolinyl)-3-[2-[3-[(4-pentylphenyl)sulfonylamino]-1-pyrrolidinyl]ethyl]urea IUPAC Name: 1-(2-methylquinolin-4-yl)-3-[2-[3-[(4-pentylphenyl)sulfonylamino]pyrrolidin-1-yl]ethyl]urea Traditional Name: 1-[2-[3-[(4-amylphenyl)sulfonylamino]pyrrolidino]ethyl]-3-(2-methyl-4-quinolyl)urea Formula: C28H37N5O3S MolecularWeight: 523.69008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(C2)CCNC(=O)NC3=CC(=NC4=CC=CC=C43)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2CCN(C2)CCNC(=O)NC3=CC(=NC4=CC=CC=C43)C

InChI

InChI=1S/C28H37N5O3S/c1-3-4-5-8-22-11-13-24(14-12-22)37(35,36)32-23-15-17-33(20-23)18-16-29-28(34)31-27-19-21(2)30-26-10-7-6-9-25(26)27/h6-7,9-14,19,23,32H,3-5,8,15-18,20H2,1-2H3,(H2,29,30,31,34)