1-tert-butyl-3-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]urea

Systemtic Name: 1-tert-butyl-3-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]urea Openeye Name: 1-tert-butyl-3-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]urea CAS Name: 1-tert-butyl-3-[3-[(4-phenyl-1-piperazinyl)sulfonyl]propyl]urea IUPAC Name: 1-tert-butyl-3-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]urea Traditional Name: 1-tert-butyl-3-[3-(4-phenylpiperazino)sulfonylpropyl]urea Formula: C18H30N4O3S MolecularWeight: 382.5208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NCCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=O)NCCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2

InChI

InChI=1S/C18H30N4O3S/c1-18(2,3)20-17(23)19-10-7-15-26(24,25)22-13-11-21(12-14-22)16-8-5-4-6-9-16/h4-6,8-9H,7,10-15H2,1-3H3,(H2,19,20,23)