2-(3-ethyl-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindazol-1-yl)-4-(oxan-4-ylamino)pyrimidine-5-carboxamide

Systemtic Name: 2-(3-ethyl-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindazol-1-yl)-4-(oxan-4-ylamino)pyrimidine-5-carboxamide Openeye Name: 2-(3-ethyl-6,6-dimethyl-4-oxo-5,7-dihydroindazol-1-yl)-4-(tetrahydropyran-4-ylamino)pyrimidine-5-carboxamide CAS Name: 2-(3-ethyl-6,6-dimethyl-4-oxo-5,7-dihydroindazol-1-yl)-4-(4-oxanylamino)-5-pyrimidinecarboxamide IUPAC Name: 2-(3-ethyl-6,6-dimethyl-4-oxo-5,7-dihydroindazol-1-yl)-4-(oxan-4-ylamino)pyrimidine-5-carboxamide Traditional Name: 2-(3-ethyl-4-keto-6,6-dimethyl-5,7-dihydroindazol-1-yl)-4-(tetrahydropyran-4-ylamino)pyrimidine-5-carboxamide Formula: C21H28N6O3 MolecularWeight: 412.48542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=NC=C(C(=N3)NC4CCOCC4)C(=O)N

Isomeric SMILES

CCC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=NC=C(C(=N3)NC4CCOCC4)C(=O)N

InChI

InChI=1S/C21H28N6O3/c1-4-14-17-15(9-21(2,3)10-16(17)28)27(26-14)20-23-11-13(18(22)29)19(25-20)24-12-5-7-30-8-6-12/h11-12H,4-10H2,1-3H3,(H2,22,29)(H,23,24,25)