1-[4-[(6-cyclohexyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]-3-propyl-urea

Systemtic Name: 1-[4-[(6-cyclohexyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]-3-propyl-urea Openeye Name: 1-[4-[(6-cyclohexyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]-3-propyl-urea CAS Name: 1-[4-[(6-cyclohexyl-3-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]cyclohexyl]-3-propylurea IUPAC Name: 1-[4-[(6-cyclohexyl-3-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]-3-propylurea Traditional Name: 1-[4-[(6-cyclohexyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]-3-propyl-urea Formula: C28H39N7O MolecularWeight: 489.65556

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1CCC(CC1)NC2=NC(=NC3=C2C(=NN3C4=CC=CC=C4)C)C5CCCCC5

Isomeric SMILES

CCCNC(=O)NC1CCC(CC1)NC2=NC(=NC3=C2C(=NN3C4=CC=CC=C4)C)C5CCCCC5

InChI

InChI=1S/C28H39N7O/c1-3-18-29-28(36)31-22-16-14-21(15-17-22)30-26-24-19(2)34-35(23-12-8-5-9-13-23)27(24)33-25(32-26)20-10-6-4-7-11-20/h5,8-9,12-13,20-22H,3-4,6-7,10-11,14-18H2,1-2H3,(H2,29,31,36)(H,30,32,33)