1-[5-tert-butyl-2-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyrazol-3-yl]-3-naphthalen-1-yl-urea

Systemtic Name: 1-[5-tert-butyl-2-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyrazol-3-yl]-3-naphthalen-1-yl-urea Openeye Name: 1-[5-tert-butyl-2-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyrazol-3-yl]-3-(1-naphthyl)urea CAS Name: 1-[5-tert-butyl-2-[3-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-3-pyrazolyl]-3-(1-naphthalenyl)urea IUPAC Name: 1-[5-tert-butyl-2-[3-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyrazol-3-yl]-3-naphthalen-1-ylurea Traditional Name: 1-[5-tert-butyl-2-[3-[2-(4-methylpiperazino)ethoxy]phenyl]pyrazol-3-yl]-3-(1-naphthyl)urea Formula: C31H38N6O2 MolecularWeight: 526.67242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC(=CC=C4)OCCN5CCN(CC5)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC(=CC=C4)OCCN5CCN(CC5)C

InChI

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