1-methyl-3-[2-[4-[(phenylmethyl)carbamoylsulfamoyl]phenyl]ethyl]-1-quinolin-2-yl-urea

Systemtic Name: 1-methyl-3-[2-[4-[(phenylmethyl)carbamoylsulfamoyl]phenyl]ethyl]-1-quinolin-2-yl-urea Openeye Name: 3-[2-[4-(benzylcarbamoylsulfamoyl)phenyl]ethyl]-1-methyl-1-(2-quinolyl)urea CAS Name: 1-methyl-3-[2-[4-[[oxo-[(phenylmethyl)amino]methyl]sulfamoyl]phenyl]ethyl]-1-(2-quinolinyl)urea IUPAC Name: 3-[2-[4-(benzylcarbamoylsulfamoyl)phenyl]ethyl]-1-methyl-1-quinolin-2-ylurea Traditional Name: 3-[2-[4-(benzylcarbamoylsulfamoyl)phenyl]ethyl]-1-methyl-1-(2-quinolyl)urea Formula: C27H27N5O4S MolecularWeight: 517.59938

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=CC=CC=C2C=C1)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CN(C1=NC2=CC=CC=C2C=C1)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O4S/c1-32(25-16-13-22-9-5-6-10-24(22)30-25)27(34)28-18-17-20-11-14-23(15-12-20)37(35,36)31-26(33)29-19-21-7-3-2-4-8-21/h2-16H,17-19H2,1H3,(H,28,34)(H2,29,31,33)