4-[3-methyl-5-(2-oxidanylidene-3-pyridin-4-yl-imidazolidin-1-yl)pentoxy]-N'-oxidanyl-benzenecarboximidamide

Systemtic Name: 4-[3-methyl-5-(2-oxidanylidene-3-pyridin-4-yl-imidazolidin-1-yl)pentoxy]-N'-oxidanyl-benzenecarboximidamide Openeye Name: N'-hydroxy-4-[3-methyl-5-[2-oxo-3-(4-pyridyl)imidazolidin-1-yl]pentoxy]benzamidine CAS Name: N'-hydroxy-4-[3-methyl-5-(2-oxo-3-pyridin-4-yl-1-imidazolidinyl)pentoxy]benzenecarboximidamide IUPAC Name: N'-hydroxy-4-[3-methyl-5-(2-oxo-3-pyridin-4-ylimidazolidin-1-yl)pentoxy]benzenecarboximidamide Traditional Name: N'-hydroxy-4-[5-[2-keto-3-(4-pyridyl)imidazolidin-1-yl]-3-methyl-pentoxy]benzamidine Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1CCN(C1=O)C2=CC=NC=C2)CCOC3=CC=C(C=C3)C(=NO)N

Isomeric SMILES

CC(CCN1CCN(C1=O)C2=CC=NC=C2)CCOC3=CC=C(C=C3)/C(=N\O)/N

InChI

InChI=1S/C21H27N5O3/c1-16(9-15-29-19-4-2-17(3-5-19)20(22)24-28)8-12-25-13-14-26(21(25)27)18-6-10-23-11-7-18/h2-7,10-11,16,28H,8-9,12-15H2,1H3,(H2,22,24)