N-[[1-methyl-5-[(E)-3-(oxidanylamino)-3-oxidanylidene-prop-1-enyl]benzimidazol-2-yl]methyl]pyridine-4-carboxamide

Systemtic Name: N-[[1-methyl-5-[(E)-3-(oxidanylamino)-3-oxidanylidene-prop-1-enyl]benzimidazol-2-yl]methyl]pyridine-4-carboxamide Openeye Name: N-[[5-[(E)-3-(hydroxyamino)-3-oxo-prop-1-enyl]-1-methyl-benzimidazol-2-yl]methyl]pyridine-4-carboxamide CAS Name: N-[[5-[(E)-3-(hydroxyamino)-3-oxoprop-1-enyl]-1-methyl-2-benzimidazolyl]methyl]-4-pyridinecarboxamide IUPAC Name: N-[[5-[(E)-3-(hydroxyamino)-3-oxoprop-1-enyl]-1-methylbenzimidazol-2-yl]methyl]pyridine-4-carboxamide Traditional Name: N-[[5-[(E)-3-(hydroxyamino)-3-keto-prop-1-enyl]-1-methyl-benzimidazol-2-yl]methyl]isonicotinamide Formula: C18H17N5O3 MolecularWeight: 351.35928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C=CC(=O)NO)N=C1CNC(=O)C3=CC=NC=C3

Isomeric SMILES

CN1C2=C(C=C(C=C2)/C=C/C(=O)NO)N=C1CNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H17N5O3/c1-23-15-4-2-12(3-5-17(24)22-26)10-14(15)21-16(23)11-20-18(25)13-6-8-19-9-7-13/h2-10,26H,11H2,1H3,(H,20,25)(H,22,24)/b5-3+