3-[4-[5-(methylamino)pentyl]-3-oxidanylidene-quinoxalin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[4-[5-(methylamino)pentyl]-3-oxidanylidene-quinoxalin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-[5-(methylamino)pentyl]-3-oxo-quinoxalin-2-yl]benzamidine CAS Name: 3-[4-[5-(methylamino)pentyl]-3-oxo-2-quinoxalinyl]benzenecarboximidamide IUPAC Name: 3-[4-[5-(methylamino)pentyl]-3-oxoquinoxalin-2-yl]benzenecarboximidamide Traditional Name: 3-[3-keto-4-[5-(methylamino)pentyl]quinoxalin-2-yl]benzamidine Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCCN1C2=CC=CC=C2N=C(C1=O)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

CNCCCCCN1C2=CC=CC=C2N=C(C1=O)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C21H25N5O/c1-24-12-5-2-6-13-26-18-11-4-3-10-17(18)25-19(21(26)27)15-8-7-9-16(14-15)20(22)23/h3-4,7-11,14,24H,2,5-6,12-13H2,1H3,(H3,22,23)