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

Systemtic Name: 1-ethyl-3-[6-[6-(propan-2-ylamino)pyridin-3-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Openeye Name: 1-ethyl-3-[6-[6-(isopropylamino)-3-pyridyl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea CAS Name: 1-ethyl-3-[6-[6-(propan-2-ylamino)-3-pyridinyl]-4-(2-pyrimidinyl)-1H-benzimidazol-2-yl]urea IUPAC Name: 1-ethyl-3-[6-[6-(propan-2-ylamino)pyridin-3-yl]-4-pyrimidin-2-yl-1H-benzimidazol-2-yl]urea Traditional Name: 1-ethyl-3-[6-[6-(isopropylamino)-3-pyridyl]-4-(2-pyrimidyl)-1H-benzimidazol-2-yl]urea Formula: C22H24N8O MolecularWeight: 416.47896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N8O/c1-4-23-22(31)30-21-28-17-11-15(14-6-7-18(26-12-14)27-13(2)3)10-16(19(17)29-21)20-24-8-5-9-25-20/h5-13H,4H2,1-3H3,(H,26,27)(H3,23,28,29,30,31)