1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidin-1-yl]ethanone

Systemtic Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidin-1-yl]ethanone Openeye Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]-1-piperidyl]ethanone CAS Name: 1-[3-[1-[[4-(5-methyl-1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-1-piperidinyl]ethanone IUPAC Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidin-1-yl]ethanone Traditional Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperidino]ethanone Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NC(C)C4CCCN(C4)C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NC(C)C4CCCN(C4)C(=O)C

InChI

InChI=1S/C21H26N6O/c1-14-6-7-19-18(11-14)23-13-27(19)20-8-9-22-21(25-20)24-15(2)17-5-4-10-26(12-17)16(3)28/h6-9,11,13,15,17H,4-5,10,12H2,1-3H3,(H,22,24,25)