1-[1-(4-bromophenyl)propyl]-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-[1-(4-bromophenyl)propyl]-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Openeye Name: 1-[1-(4-bromophenyl)propyl]-3-[[4-(1-piperidylsulfonyl)phenyl]methyl]urea CAS Name: 1-[1-(4-bromophenyl)propyl]-3-[[4-(1-piperidinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-[1-(4-bromophenyl)propyl]-3-[(4-piperidin-1-ylsulfonylphenyl)methyl]urea Traditional Name: 1-[1-(4-bromophenyl)propyl]-3-(4-piperidinosulfonylbenzyl)urea Formula: C22H28BrN3O3S MolecularWeight: 494.44502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC(C1=CC=C(C=C1)Br)NC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28BrN3O3S/c1-2-21(18-8-10-19(23)11-9-18)25-22(27)24-16-17-6-12-20(13-7-17)30(28,29)26-14-4-3-5-15-26/h6-13,21H,2-5,14-16H2,1H3,(H2,24,25,27)