N-[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-6-yl]ethanesulfonamide

Systemtic Name: N-[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-6-yl]ethanesulfonamide Openeye Name: N-[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-6-yl]ethanesulfonamide CAS Name: N-[(3E)-3-[5-(4-methyl-1-piperazinyl)-2-benzimidazolylidene]-1,2-dihydroindazol-6-yl]ethanesulfonamide IUPAC Name: N-[(3E)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-6-yl]ethanesulfonamide Traditional Name: N-[(3E)-3-[5-(4-methylpiperazino)benzimidazol-2-ylidene]indazolin-6-yl]ethanesulfonamide Formula: C21H25N7O2S MolecularWeight: 439.5339

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC2=C(C=C1)C(=C3N=C4C=CC(=CC4=N3)N5CCN(CC5)C)NN2

Isomeric SMILES

CCS(=O)(=O)NC1=CC2=C(C=C1)/C(=C\3/N=C4C=CC(=CC4=N3)N5CCN(CC5)C)/NN2

InChI

InChI=1S/C21H25N7O2S/c1-3-31(29,30)26-14-4-6-16-18(12-14)24-25-20(16)21-22-17-7-5-15(13-19(17)23-21)28-10-8-27(2)9-11-28/h4-7,12-13,24-26H,3,8-11H2,1-2H3/b21-20+