tert-butyl 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-4-methyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-4-methyl-piperazine-1-carboxylate Openeye Name: tert-butyl 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-4-methyl-piperazine-1-carboxylate CAS Name: 3-[1-[[4-(1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-4-methyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-4-methylpiperazine-1-carboxylate Traditional Name: 3-[1-[[4-(benzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-4-methyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C23H31N7O2 MolecularWeight: 437.53794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CN(CCN1C)C(=O)OC(C)(C)C)NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C1CN(CCN1C)C(=O)OC(C)(C)C)NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C23H31N7O2/c1-16(19-14-29(13-12-28(19)5)22(31)32-23(2,3)4)26-21-24-11-10-20(27-21)30-15-25-17-8-6-7-9-18(17)30/h6-11,15-16,19H,12-14H2,1-5H3,(H,24,26,27)