3-[5-[4-[4-(dimethylamino)piperidin-1-yl]pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[5-[4-[4-(dimethylamino)piperidin-1-yl]pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]benzenecarboximidamide Openeye Name: 3-[5-[4-[4-(dimethylamino)-1-piperidyl]pentyl]-3-oxo-4H-quinoxalin-2-yl]benzamidine CAS Name: 3-[5-[4-[4-(dimethylamino)-1-piperidinyl]pentyl]-3-oxo-4H-quinoxalin-2-yl]benzenecarboximidamide IUPAC Name: 3-[5-[4-[4-(dimethylamino)piperidin-1-yl]pentyl]-3-oxo-4H-quinoxalin-2-yl]benzenecarboximidamide Traditional Name: 3-[5-[4-[4-(dimethylamino)piperidino]pentyl]-3-keto-4H-quinoxalin-2-yl]benzamidine Formula: C27H36N6O MolecularWeight: 460.61434

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=C2C(=CC=C1)N=C(C(=O)N2)C3=CC(=CC=C3)C(=N)N)N4CCC(CC4)N(C)C

Isomeric SMILES

CC(CCCC1=C2C(=CC=C1)N=C(C(=O)N2)C3=CC(=CC=C3)C(=N)N)N4CCC(CC4)N(C)C

InChI

InChI=1S/C27H36N6O/c1-18(33-15-13-22(14-16-33)32(2)3)7-4-8-19-9-6-12-23-24(19)31-27(34)25(30-23)20-10-5-11-21(17-20)26(28)29/h5-6,9-12,17-18,22H,4,7-8,13-16H2,1-3H3,(H3,28,29)(H,31,34)