(2E)-N'-ethyl-2-[4-[hydroxymethyl(phenethyl)amino]-2-oxidanylidene-pyridin-3-ylidene]-7-methyl-1,3-dihydrobenzimidazole-5-carboximidamide

Systemtic Name: (2E)-N'-ethyl-2-[4-[hydroxymethyl(phenethyl)amino]-2-oxidanylidene-pyridin-3-ylidene]-7-methyl-1,3-dihydrobenzimidazole-5-carboximidamide Openeye Name: (2E)-N'-ethyl-2-[4-[hydroxymethyl(phenethyl)amino]-2-oxo-3-pyridylidene]-7-methyl-1,3-dihydrobenzimidazole-5-carboxamidine CAS Name: (2E)-N'-ethyl-2-[4-[hydroxymethyl(phenethyl)amino]-2-oxo-3-pyridinylidene]-7-methyl-1,3-dihydrobenzimidazole-5-carboximidamide IUPAC Name: (2E)-N'-ethyl-2-[4-[hydroxymethyl(phenethyl)amino]-2-oxopyridin-3-ylidene]-7-methyl-1,3-dihydrobenzimidazole-5-carboximidamide Traditional Name: (2E)-N'-ethyl-2-[2-keto-4-[methylol(phenethyl)amino]-3-pyridylidene]-7-methyl-1,3-dihydrobenzimidazole-5-carboxamidine Formula: C25H28N6O2 MolecularWeight: 444.52882

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(C1=CC(=C2C(=C1)NC(=C3C(=CC=NC3=O)N(CCC4=CC=CC=C4)CO)N2)C)N

Isomeric SMILES

CCN=C(C1=CC(=C2C(=C1)N/C(=C\3/C(=CC=NC3=O)N(CCC4=CC=CC=C4)CO)/N2)C)N

InChI

InChI=1S/C25H28N6O2/c1-3-27-23(26)18-13-16(2)22-19(14-18)29-24(30-22)21-20(9-11-28-25(21)33)31(15-32)12-10-17-7-5-4-6-8-17/h4-9,11,13-14,29-30,32H,3,10,12,15H2,1-2H3,(H2,26,27)/b24-21+