(3Z)-4-azanyl-6-iodanyl-3-[5-(4-methylpiperazin-1-yl)-1,3-dihydrobenzimidazol-2-ylidene]quinolin-2-one

Systemtic Name: (3Z)-4-azanyl-6-iodanyl-3-[5-(4-methylpiperazin-1-yl)-1,3-dihydrobenzimidazol-2-ylidene]quinolin-2-one Openeye Name: (3Z)-4-amino-6-iodo-3-[5-(4-methylpiperazin-1-yl)-1,3-dihydrobenzimidazol-2-ylidene]quinolin-2-one CAS Name: (3Z)-4-amino-6-iodo-3-[5-(4-methyl-1-piperazinyl)-1,3-dihydrobenzimidazol-2-ylidene]-2-quinolinone IUPAC Name: (3Z)-4-amino-6-iodo-3-[5-(4-methylpiperazin-1-yl)-1,3-dihydrobenzimidazol-2-ylidene]quinolin-2-one Traditional Name: (3Z)-4-amino-6-iodo-3-[5-(4-methylpiperazino)-1,3-dihydrobenzimidazol-2-ylidene]carbostyril Formula: C21H21IN6O MolecularWeight: 500.33551

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C2)NC(=C4C(=C5C=C(C=CC5=NC4=O)I)N)N3

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)N/C(=C/4\C(=C5C=C(C=CC5=NC4=O)I)N)/N3

InChI

InChI=1S/C21H21IN6O/c1-27-6-8-28(9-7-27)13-3-5-16-17(11-13)25-20(24-16)18-19(23)14-10-12(22)2-4-15(14)26-21(18)29/h2-5,10-11,24-25H,6-9,23H2,1H3/b20-18-