1-tert-butyl-3-[4-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]naphthalen-1-yl]-1-(2-phenylpyrazol-3-yl)urea

Systemtic Name: 1-tert-butyl-3-[4-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]naphthalen-1-yl]-1-(2-phenylpyrazol-3-yl)urea Openeye Name: 1-tert-butyl-3-[4-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-naphthyl]-1-(2-phenylpyrazol-3-yl)urea CAS Name: 1-tert-butyl-3-[4-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-1-naphthalenyl]-1-(2-phenyl-3-pyrazolyl)urea IUPAC Name: 1-tert-butyl-3-[4-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]naphthalen-1-yl]-1-(2-phenylpyrazol-3-yl)urea Traditional Name: 1-tert-butyl-3-[4-[4-[(4-methylpiperazino)methyl]phenyl]-1-naphthyl]-1-(2-phenylpyrazol-3-yl)urea Formula: C36H40N6O MolecularWeight: 572.7424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C1=CC=NN1C2=CC=CC=C2)C(=O)NC3=CC=C(C4=CC=CC=C43)C5=CC=C(C=C5)CN6CCN(CC6)C

Isomeric SMILES

CC(C)(C)N(C1=CC=NN1C2=CC=CC=C2)C(=O)NC3=CC=C(C4=CC=CC=C43)C5=CC=C(C=C5)CN6CCN(CC6)C

InChI

InChI=1S/C36H40N6O/c1-36(2,3)41(34-20-21-37-42(34)29-10-6-5-7-11-29)35(43)38-33-19-18-30(31-12-8-9-13-32(31)33)28-16-14-27(15-17-28)26-40-24-22-39(4)23-25-40/h5-21H,22-26H2,1-4H3,(H,38,43)