1-pentan-2-yl-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-pentan-2-yl-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]urea Openeye Name: 1-(1-methylbutyl)-3-[[2-(1-piperidylsulfonyl)phenyl]methyl]urea CAS Name: 1-pentan-2-yl-3-[[2-(1-piperidinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-pentan-2-yl-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]urea Traditional Name: 1-(1-methylbutyl)-3-(2-piperidinosulfonylbenzyl)urea Formula: C18H29N3O3S MolecularWeight: 367.50616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)NCC1=CC=CC=C1S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCCC(C)NC(=O)NCC1=CC=CC=C1S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C18H29N3O3S/c1-3-9-15(2)20-18(22)19-14-16-10-5-6-11-17(16)25(23,24)21-12-7-4-8-13-21/h5-6,10-11,15H,3-4,7-9,12-14H2,1-2H3,(H2,19,20,22)