1-ethyl-3-[6-(6-propylpyridin-3-yl)-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea

Systemtic Name: 1-ethyl-3-[6-(6-propylpyridin-3-yl)-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Openeye Name: 1-ethyl-3-[6-(6-propyl-3-pyridyl)-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea CAS Name: 1-ethyl-3-[6-(6-propyl-3-pyridinyl)-4-(2-pyrimidinyl)-1H-benzimidazol-2-yl]urea IUPAC Name: 1-ethyl-3-[6-(6-propylpyridin-3-yl)-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Traditional Name: 1-ethyl-3-[6-(6-propyl-3-pyridyl)-4-(2-pyrimidyl)-1H-benzimidazol-2-yl]urea Formula: C22H23N7O MolecularWeight: 401.46432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=C(C=C1)C2=CC(=C3C(=C2)NC(=N3)NC(=O)NCC)C4=NC=CC=N4

Isomeric SMILES

CCCC1=NC=C(C=C1)C2=CC(=C3C(=C2)NC(=N3)NC(=O)NCC)C4=NC=CC=N4

InChI

InChI=1S/C22H23N7O/c1-3-6-16-8-7-14(13-26-16)15-11-17(20-24-9-5-10-25-20)19-18(12-15)27-21(28-19)29-22(30)23-4-2/h5,7-13H,3-4,6H2,1-2H3,(H3,23,27,28,29,30)