(2E)-2-[5-(4-azanyl-2-oxidanylidene-1-pyrrolidin-2-yl-butoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-1,3-dihydrobenzimidazole-5-carboximidamide

Systemtic Name: (2E)-2-[5-(4-azanyl-2-oxidanylidene-1-pyrrolidin-2-yl-butoxy)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-1,3-dihydrobenzimidazole-5-carboximidamide Openeye Name: (2E)-2-[5-(4-amino-2-oxo-1-pyrrolidin-2-yl-butoxy)-6-oxo-cyclohexa-2,4-dien-1-ylidene]-1,3-dihydrobenzimidazole-5-carboxamidine CAS Name: (2E)-2-[5-[4-amino-2-oxo-1-(2-pyrrolidinyl)butoxy]-6-oxo-1-cyclohexa-2,4-dienylidene]-1,3-dihydrobenzimidazole-5-carboximidamide IUPAC Name: (2E)-2-[5-(4-amino-2-oxo-1-pyrrolidin-2-ylbutoxy)-6-oxocyclohexa-2,4-dien-1-ylidene]-1,3-dihydrobenzimidazole-5-carboximidamide Traditional Name: (2E)-2-[5-(4-amino-2-keto-1-pyrrolidin-2-yl-butoxy)-6-keto-cyclohexa-2,4-dien-1-ylidene]-1,3-dihydrobenzimidazole-5-carboxamidine Formula: C22H26N6O3 MolecularWeight: 422.48024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(C(=O)CCN)OC2=CC=CC(=C3NC4=C(N3)C=C(C=C4)C(=N)N)C2=O

Isomeric SMILES

C1CC(NC1)C(C(=O)CCN)OC2=CC=C/C(=C\3/NC4=C(N3)C=C(C=C4)C(=N)N)/C2=O

InChI

InChI=1S/C22H26N6O3/c23-9-8-17(29)20(15-4-2-10-26-15)31-18-5-1-3-13(19(18)30)22-27-14-7-6-12(21(24)25)11-16(14)28-22/h1,3,5-7,11,15,20,26-28H,2,4,8-10,23H2,(H3,24,25)/b22-13+