3-[1-[[2-(benzimidazol-1-yl)pyrimidin-4-yl]amino]ethyl]-N-ethyl-benzamide

Systemtic Name: 3-[1-[[2-(benzimidazol-1-yl)pyrimidin-4-yl]amino]ethyl]-N-ethyl-benzamide Openeye Name: 3-[1-[[2-(benzimidazol-1-yl)pyrimidin-4-yl]amino]ethyl]-N-ethyl-benzamide CAS Name: 3-[1-[[2-(1-benzimidazolyl)-4-pyrimidinyl]amino]ethyl]-N-ethylbenzamide IUPAC Name: 3-[1-[[2-(benzimidazol-1-yl)pyrimidin-4-yl]amino]ethyl]-N-ethylbenzamide Traditional Name: 3-[1-[[2-(benzimidazol-1-yl)pyrimidin-4-yl]amino]ethyl]-N-ethyl-benzamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)C(C)NC2=NC(=NC=C2)N3C=NC4=CC=CC=C43

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)C(C)NC2=NC(=NC=C2)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H22N6O/c1-3-23-21(29)17-8-6-7-16(13-17)15(2)26-20-11-12-24-22(27-20)28-14-25-18-9-4-5-10-19(18)28/h4-15H,3H2,1-2H3,(H,23,29)(H,24,26,27)