1-[2-[4-[(4-bromophenyl)sulfonyl-propyl-amino]piperidin-1-yl]ethyl]-3-(2-methylquinolin-4-yl)urea

Systemtic Name: 1-[2-[4-[(4-bromophenyl)sulfonyl-propyl-amino]piperidin-1-yl]ethyl]-3-(2-methylquinolin-4-yl)urea Openeye Name: 1-[2-[4-[(4-bromophenyl)sulfonyl-propyl-amino]-1-piperidyl]ethyl]-3-(2-methyl-4-quinolyl)urea CAS Name: 1-[2-[4-[(4-bromophenyl)sulfonyl-propylamino]-1-piperidinyl]ethyl]-3-(2-methyl-4-quinolinyl)urea IUPAC Name: 1-[2-[4-[(4-bromophenyl)sulfonyl-propylamino]piperidin-1-yl]ethyl]-3-(2-methylquinolin-4-yl)urea Traditional Name: 1-[2-[4-[brosyl(propyl)amino]piperidino]ethyl]-3-(2-methyl-4-quinolyl)urea Formula: C27H34BrN5O3S MolecularWeight: 588.55956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCN(CC1)CCNC(=O)NC2=CC(=NC3=CC=CC=C32)C)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCN(C1CCN(CC1)CCNC(=O)NC2=CC(=NC3=CC=CC=C32)C)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H34BrN5O3S/c1-3-15-33(37(35,36)23-10-8-21(28)9-11-23)22-12-16-32(17-13-22)18-14-29-27(34)31-26-19-20(2)30-25-7-5-4-6-24(25)26/h4-11,19,22H,3,12-18H2,1-2H3,(H2,29,30,31,34)