tert-butyl 4-(3-but-2-ynyl-4-chloranyl-imidazo[4,5-c]pyridin-2-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-but-2-ynyl-4-chloranyl-imidazo[4,5-c]pyridin-2-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-but-2-ynyl-4-chloro-imidazo[4,5-c]pyridin-2-yl)piperazine-1-carboxylate CAS Name: 4-(3-but-2-ynyl-4-chloro-2-imidazo[4,5-c]pyridinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-but-2-ynyl-4-chloroimidazo[4,5-c]pyridin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(3-but-2-ynyl-4-chloro-imidazo[4,5-c]pyridin-2-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H24ClN5O2 MolecularWeight: 389.87916

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(C=CN=C2Cl)N=C1N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC#CCN1C2=C(C=CN=C2Cl)N=C1N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H24ClN5O2/c1-5-6-9-25-15-14(7-8-21-16(15)20)22-17(25)23-10-12-24(13-11-23)18(26)27-19(2,3)4/h7-8H,9-13H2,1-4H3