tert-butyl 4-[3,4-bis(azanyl)-2-fluoranyl-6-methyl-phenyl]-3-methyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3,4-bis(azanyl)-2-fluoranyl-6-methyl-phenyl]-3-methyl-piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3,4-diamino-2-fluoro-6-methyl-phenyl)-3-methyl-piperazine-1-carboxylate CAS Name: 4-(3,4-diamino-2-fluoro-6-methylphenyl)-3-methyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3,4-diamino-2-fluoro-6-methylphenyl)-3-methylpiperazine-1-carboxylate Traditional Name: 4-(3,4-diamino-2-fluoro-6-methyl-phenyl)-3-methyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C17H27FN4O2 MolecularWeight: 338.420283

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=C(C(=C(C=C2C)N)N)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CN(CCN1C2=C(C(=C(C=C2C)N)N)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H27FN4O2/c1-10-8-12(19)14(20)13(18)15(10)22-7-6-21(9-11(22)2)16(23)24-17(3,4)5/h8,11H,6-7,9,19-20H2,1-5H3