1-[5-azanyl-3-phenyl-1-(phenylmethyl)pyrazol-4-yl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-[5-azanyl-3-phenyl-1-(phenylmethyl)pyrazol-4-yl]-3-[3-(4-methylpiperazin-1-yl)propyl]urea Openeye Name: 1-(5-amino-1-benzyl-3-phenyl-pyrazol-4-yl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea CAS Name: 1-[5-amino-3-phenyl-1-(phenylmethyl)-4-pyrazolyl]-3-[3-(4-methyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(5-amino-1-benzyl-3-phenylpyrazol-4-yl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea Traditional Name: 1-(5-amino-1-benzyl-3-phenyl-pyrazol-4-yl)-3-[3-(4-methylpiperazino)propyl]urea Formula: C25H33N7O MolecularWeight: 447.57582

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)NC2=C(N(N=C2C3=CC=CC=C3)CC4=CC=CC=C4)N

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)NC2=C(N(N=C2C3=CC=CC=C3)CC4=CC=CC=C4)N

InChI

InChI=1S/C25H33N7O/c1-30-15-17-31(18-16-30)14-8-13-27-25(33)28-23-22(21-11-6-3-7-12-21)29-32(24(23)26)19-20-9-4-2-5-10-20/h2-7,9-12H,8,13-19,26H2,1H3,(H2,27,28,33)