1-(5-azanyl-1,3-ditert-butyl-pyrazol-4-yl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(5-azanyl-1,3-ditert-butyl-pyrazol-4-yl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea Openeye Name: 1-(5-amino-1,3-ditert-butyl-pyrazol-4-yl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea CAS Name: 1-(5-amino-1,3-ditert-butyl-4-pyrazolyl)-3-[3-(4-methyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(5-amino-1,3-ditert-butylpyrazol-4-yl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea Traditional Name: 1-(5-amino-1,3-ditert-butyl-pyrazol-4-yl)-3-[3-(4-methylpiperazino)propyl]urea Formula: C20H39N7O MolecularWeight: 393.56996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1NC(=O)NCCCN2CCN(CC2)C)N)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1NC(=O)NCCCN2CCN(CC2)C)N)C(C)(C)C

InChI

InChI=1S/C20H39N7O/c1-19(2,3)16-15(17(21)27(24-16)20(4,5)6)23-18(28)22-9-8-10-26-13-11-25(7)12-14-26/h8-14,21H2,1-7H3,(H2,22,23,28)