(3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-4-(pyrimidin-2-ylmethylamino)pyridin-2-one

Systemtic Name: (3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-4-(pyrimidin-2-ylmethylamino)pyridin-2-one Openeye Name: (3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-4-(pyrimidin-2-ylmethylamino)pyridin-2-one CAS Name: (3Z)-3-[6-(1-imidazolyl)-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]-4-(2-pyrimidinylmethylamino)-2-pyridinone IUPAC Name: (3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-4-(pyrimidin-2-ylmethylamino)pyridin-2-one Traditional Name: (3Z)-3-(6-imidazol-1-yl-4-methyl-1,3-dihydrobenzimidazol-2-ylidene)-4-(2-pyrimidylmethylamino)-2-pyridone Formula: C21H18N8O MolecularWeight: 398.42062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C3C(=CC=NC3=O)NCC4=NC=CC=N4)N2)N5C=CN=C5

Isomeric SMILES

CC1=CC(=CC2=C1N/C(=C\3/C(=CC=NC3=O)NCC4=NC=CC=N4)/N2)N5C=CN=C5

InChI

InChI=1S/C21H18N8O/c1-13-9-14(29-8-7-22-12-29)10-16-19(13)28-20(27-16)18-15(3-6-25-21(18)30)26-11-17-23-4-2-5-24-17/h2-10,12,26-28H,11H2,1H3/b20-18-