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

Systemtic Name: 1-[4-methyl-3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-methyl-3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazin-1-yl]ethanone CAS Name: 1-[4-methyl-3-[1-[[4-(5-methyl-1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-methyl-3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-methyl-3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazino]ethanone Formula: C21H27N7O MolecularWeight: 393.48538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NC(C)C4CN(CCN4C)C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NC(C)C4CN(CCN4C)C(=O)C

InChI

InChI=1S/C21H27N7O/c1-14-5-6-18-17(11-14)23-13-28(18)20-7-8-22-21(25-20)24-15(2)19-12-27(16(3)29)10-9-26(19)4/h5-8,11,13,15,19H,9-10,12H2,1-4H3,(H,22,24,25)