1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-piperazin-1-ylethoxy)naphthalen-1-yl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-piperazin-1-ylethoxy)naphthalen-1-yl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-(2-piperazin-1-ylethoxy)-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[4-[2-(1-piperazinyl)ethoxy]-1-naphthalenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-(2-piperazin-1-ylethoxy)naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-(2-piperazinoethoxy)-1-naphthyl]urea Formula: C31H38N6O2 MolecularWeight: 526.67242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)OCCN5CCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)OCCN5CCNCC5

InChI

InChI=1S/C31H38N6O2/c1-22-9-11-23(12-10-22)37-29(21-28(35-37)31(2,3)4)34-30(38)33-26-13-14-27(25-8-6-5-7-24(25)26)39-20-19-36-17-15-32-16-18-36/h5-14,21,32H,15-20H2,1-4H3,(H2,33,34,38)