tert-butyl 6-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)-methyl-amino]-3-methyl-indazole-1-carboxylate

Systemtic Name: tert-butyl 6-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)-methyl-amino]-3-methyl-indazole-1-carboxylate Openeye Name: tert-butyl 6-[(2-chloro-5-fluoro-pyrimidin-4-yl)-methyl-amino]-3-methyl-indazole-1-carboxylate CAS Name: 6-[(2-chloro-5-fluoro-4-pyrimidinyl)-methylamino]-3-methyl-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-[(2-chloro-5-fluoropyrimidin-4-yl)-methylamino]-3-methylindazole-1-carboxylate Traditional Name: 6-[(2-chloro-5-fluoro-pyrimidin-4-yl)-methyl-amino]-3-methyl-indazole-1-carboxylic acid tert-butyl ester Formula: C18H19ClFN5O2 MolecularWeight: 391.827163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=CC(=C2)N(C)C3=NC(=NC=C3F)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=NN(C2=C1C=CC(=C2)N(C)C3=NC(=NC=C3F)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H19ClFN5O2/c1-10-12-7-6-11(24(5)15-13(20)9-21-16(19)22-15)8-14(12)25(23-10)17(26)27-18(2,3)4/h6-9H,1-5H3