1-(3-bromophenyl)-3-[(1,3-dimethyl-4-propan-2-yl-pyrazolo[3,4-b]pyridin-6-yl)amino]urea

Systemtic Name: 1-(3-bromophenyl)-3-[(1,3-dimethyl-4-propan-2-yl-pyrazolo[3,4-b]pyridin-6-yl)amino]urea Openeye Name: 1-(3-bromophenyl)-3-[(4-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)amino]urea CAS Name: 1-(3-bromophenyl)-3-[(1,3-dimethyl-4-propan-2-yl-6-pyrazolo[3,4-b]pyridinyl)amino]urea IUPAC Name: 1-(3-bromophenyl)-3-[(1,3-dimethyl-4-propan-2-ylpyrazolo[3,4-b]pyridin-6-yl)amino]urea Traditional Name: 1-(3-bromophenyl)-3-[(4-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)amino]urea Formula: C18H21BrN6O MolecularWeight: 417.30294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)NNC(=O)NC3=CC(=CC=C3)Br)C(C)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)NNC(=O)NC3=CC(=CC=C3)Br)C(C)C)C

InChI

InChI=1S/C18H21BrN6O/c1-10(2)14-9-15(21-17-16(14)11(3)24-25(17)4)22-23-18(26)20-13-7-5-6-12(19)8-13/h5-10H,1-4H3,(H,21,22)(H2,20,23,26)