3-phenethyl-1-(4-phenylbutan-2-yl)-1-[2-(piperazin-1-ylmethyl)prop-2-enyl]urea

Systemtic Name: 3-phenethyl-1-(4-phenylbutan-2-yl)-1-[2-(piperazin-1-ylmethyl)prop-2-enyl]urea Openeye Name: 1-(1-methyl-3-phenyl-propyl)-3-phenethyl-1-[2-(piperazin-1-ylmethyl)allyl]urea CAS Name: 3-phenethyl-1-(4-phenylbutan-2-yl)-1-[2-(1-piperazinylmethyl)prop-2-enyl]urea IUPAC Name: 3-phenethyl-1-(4-phenylbutan-2-yl)-1-[2-(piperazin-1-ylmethyl)prop-2-enyl]urea Traditional Name: 1-(1-methyl-3-phenyl-propyl)-3-phenethyl-1-[2-(piperazinomethyl)allyl]urea Formula: C27H38N4O MolecularWeight: 434.61682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N(CC(=C)CN2CCNCC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(CCC1=CC=CC=C1)N(CC(=C)CN2CCNCC2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C27H38N4O/c1-23(21-30-19-17-28-18-20-30)22-31(24(2)13-14-25-9-5-3-6-10-25)27(32)29-16-15-26-11-7-4-8-12-26/h3-12,24,28H,1,13-22H2,2H3,(H,29,32)