(2Z)-N',7-dimethyl-2-[2-oxidanylidene-4-(pyridin-2-ylmethylamino)pyridin-3-ylidene]-1,3-dihydrobenzimidazole-5-carboximidamide

Systemtic Name: (2Z)-N',7-dimethyl-2-[2-oxidanylidene-4-(pyridin-2-ylmethylamino)pyridin-3-ylidene]-1,3-dihydrobenzimidazole-5-carboximidamide Openeye Name: (2Z)-N',7-dimethyl-2-[2-oxo-4-(2-pyridylmethylamino)-3-pyridylidene]-1,3-dihydrobenzimidazole-5-carboxamidine CAS Name: (2Z)-N',7-dimethyl-2-[2-oxo-4-(2-pyridinylmethylamino)-3-pyridinylidene]-1,3-dihydrobenzimidazole-5-carboximidamide IUPAC Name: (2Z)-N',7-dimethyl-2-[2-oxo-4-(pyridin-2-ylmethylamino)pyridin-3-ylidene]-1,3-dihydrobenzimidazole-5-carboximidamide Traditional Name: (2Z)-2-[2-keto-4-(2-pyridylmethylamino)-3-pyridylidene]-N',7-dimethyl-1,3-dihydrobenzimidazole-5-carboxamidine Formula: C21H21N7O MolecularWeight: 387.43774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(=NC)N)NC(=C3C(=CC=NC3=O)NCC4=CC=CC=N4)N2

Isomeric SMILES

CC1=C2C(=CC(=C1)C(=NC)N)N/C(=C/3\C(=CC=NC3=O)NCC4=CC=CC=N4)/N2

InChI

InChI=1S/C21H21N7O/c1-12-9-13(19(22)23-2)10-16-18(12)28-20(27-16)17-15(6-8-25-21(17)29)26-11-14-5-3-4-7-24-14/h3-10,26-28H,11H2,1-2H3,(H2,22,23)/b20-17-