1-cyclohexyl-3-[4-(1,3,5-trimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]urea

Systemtic Name: 1-cyclohexyl-3-[4-(1,3,5-trimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]urea Openeye Name: 1-cyclohexyl-3-[4-(1,3,5-trimethyl-7-oxo-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]urea CAS Name: 1-cyclohexyl-3-[4-(1,3,5-trimethyl-7-oxo-6-pyrazolo[4,3-d]pyrimidinyl)phenyl]urea IUPAC Name: 1-cyclohexyl-3-[4-(1,3,5-trimethyl-7-oxopyrazolo[4,3-d]pyrimidin-6-yl)phenyl]urea Traditional Name: 1-cyclohexyl-3-[4-(7-keto-1,3,5-trimethyl-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]urea Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N(C2=O)C3=CC=C(C=C3)NC(=O)NC4CCCCC4)C)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)C3=CC=C(C=C3)NC(=O)NC4CCCCC4)C)C

InChI

InChI=1S/C21H26N6O2/c1-13-18-19(26(3)25-13)20(28)27(14(2)22-18)17-11-9-16(10-12-17)24-21(29)23-15-7-5-4-6-8-15/h9-12,15H,4-8H2,1-3H3,(H2,23,24,29)