1-(2-methyl-5-phenyl-phenyl)-3-[4-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]naphthalen-1-yl]urea

Systemtic Name: 1-(2-methyl-5-phenyl-phenyl)-3-[4-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]naphthalen-1-yl]urea Openeye Name: 1-(2-methyl-5-phenyl-phenyl)-3-[4-[4-[2-(4-pyridyl)ethyl]piperazin-1-yl]-1-naphthyl]urea CAS Name: 1-(2-methyl-5-phenylphenyl)-3-[4-[4-(2-pyridin-4-ylethyl)-1-piperazinyl]-1-naphthalenyl]urea IUPAC Name: 1-(2-methyl-5-phenylphenyl)-3-[4-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]naphthalen-1-yl]urea Traditional Name: 1-(2-methyl-5-phenyl-phenyl)-3-[4-[4-[2-(4-pyridyl)ethyl]piperazino]-1-naphthyl]urea Formula: C35H35N5O MolecularWeight: 541.6853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=CC=C2)NC(=O)NC3=CC=C(C4=CC=CC=C43)N5CCN(CC5)CCC6=CC=NC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=CC=C2)NC(=O)NC3=CC=C(C4=CC=CC=C43)N5CCN(CC5)CCC6=CC=NC=C6

InChI

InChI=1S/C35H35N5O/c1-26-11-12-29(28-7-3-2-4-8-28)25-33(26)38-35(41)37-32-13-14-34(31-10-6-5-9-30(31)32)40-23-21-39(22-24-40)20-17-27-15-18-36-19-16-27/h2-16,18-19,25H,17,20-24H2,1H3,(H2,37,38,41)