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

Systemtic Name: 1-[(1,3-dimethyl-4-propan-2-yl-pyrazolo[3,4-b]pyridin-6-yl)amino]-3-[2-(4-nitrophenyl)-1,3-thiazol-4-yl]urea Openeye Name: 1-[(4-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)amino]-3-[2-(4-nitrophenyl)thiazol-4-yl]urea CAS Name: 1-[(1,3-dimethyl-4-propan-2-yl-6-pyrazolo[3,4-b]pyridinyl)amino]-3-[2-(4-nitrophenyl)-4-thiazolyl]urea IUPAC Name: 1-[(1,3-dimethyl-4-propan-2-ylpyrazolo[3,4-b]pyridin-6-yl)amino]-3-[2-(4-nitrophenyl)-1,3-thiazol-4-yl]urea Traditional Name: 1-[(4-isopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridin-6-yl)amino]-3-[2-(4-nitrophenyl)thiazol-4-yl]urea Formula: C21H22N8O3S MolecularWeight: 466.51618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)NNC(=O)NC3=CSC(=N3)C4=CC=C(C=C4)[N+](=O)[O-])C(C)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)NNC(=O)NC3=CSC(=N3)C4=CC=C(C=C4)[N+](=O)[O-])C(C)C)C

InChI

InChI=1S/C21H22N8O3S/c1-11(2)15-9-16(22-19-18(15)12(3)27-28(19)4)25-26-21(30)24-17-10-33-20(23-17)13-5-7-14(8-6-13)29(31)32/h5-11H,1-4H3,(H,22,25)(H2,24,26,30)