1-(3-azanyl-5-fluoranyl-1-methyl-indazol-6-yl)-3,6,6-trimethyl-5,7-dihydroindazol-4-one

Systemtic Name: 1-(3-azanyl-5-fluoranyl-1-methyl-indazol-6-yl)-3,6,6-trimethyl-5,7-dihydroindazol-4-one Openeye Name: 1-(3-amino-5-fluoro-1-methyl-indazol-6-yl)-3,6,6-trimethyl-5,7-dihydroindazol-4-one CAS Name: 1-(3-amino-5-fluoro-1-methyl-6-indazolyl)-3,6,6-trimethyl-5,7-dihydroindazol-4-one IUPAC Name: 1-(3-amino-5-fluoro-1-methylindazol-6-yl)-3,6,6-trimethyl-5,7-dihydroindazol-4-one Traditional Name: 1-(3-amino-5-fluoro-1-methyl-indazol-6-yl)-3,6,6-trimethyl-5,7-dihydroindazol-4-one Formula: C18H20FN5O MolecularWeight: 341.382703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=C(C=C4C(=C3)N(N=C4N)C)F

Isomeric SMILES

CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=C(C=C4C(=C3)N(N=C4N)C)F

InChI

InChI=1S/C18H20FN5O/c1-9-16-14(7-18(2,3)8-15(16)25)24(21-9)13-6-12-10(5-11(13)19)17(20)22-23(12)4/h5-6H,7-8H2,1-4H3,(H2,20,22)