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

Systemtic Name: 1-ethyl-3-[6-[6-(2-methylpropyl)pyridin-3-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Openeye Name: 1-ethyl-3-[6-(6-isobutyl-3-pyridyl)-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea CAS Name: 1-ethyl-3-[6-[6-(2-methylpropyl)-3-pyridinyl]-4-(2-pyrimidinyl)-1H-benzimidazol-2-yl]urea IUPAC Name: 1-ethyl-3-[6-[6-(2-methylpropyl)pyridin-3-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Traditional Name: 1-ethyl-3-[6-(6-isobutyl-3-pyridyl)-4-(2-pyrimidyl)-1H-benzimidazol-2-yl]urea Formula: C23H25N7O MolecularWeight: 415.4909

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CN=C(C=C3)CC(C)C)C4=NC=CC=N4

Isomeric SMILES

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CN=C(C=C3)CC(C)C)C4=NC=CC=N4

InChI

InChI=1S/C23H25N7O/c1-4-24-23(31)30-22-28-19-12-16(15-6-7-17(27-13-15)10-14(2)3)11-18(20(19)29-22)21-25-8-5-9-26-21/h5-9,11-14H,4,10H2,1-3H3,(H3,24,28,29,30,31)