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

Systemtic Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazin-1-yl]ethanone Openeye Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazin-1-yl]ethanone CAS Name: 1-[3-[1-[[4-(5-methyl-1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazin-1-yl]ethanone Traditional Name: 1-[3-[1-[[4-(5-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazino]ethanone Formula: C20H25N7O MolecularWeight: 379.4588

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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(CCN4)C(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NC(C)C4CN(CCN4)C(=O)C

InChI

InChI=1S/C20H25N7O/c1-13-4-5-18-16(10-13)23-12-27(18)19-6-7-22-20(25-19)24-14(2)17-11-26(15(3)28)9-8-21-17/h4-7,10,12,14,17,21H,8-9,11H2,1-3H3,(H,22,24,25)