N-[(3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]ethanamide

Systemtic Name: N-[(3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]ethanamide Openeye Name: N-[(3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]acetamide CAS Name: N-[(3Z)-3-[5-(4-methyl-1-piperazinyl)-2-benzimidazolylidene]-1,2-dihydroindazol-4-yl]acetamide IUPAC Name: N-[(3Z)-3-[5-(4-methylpiperazin-1-yl)benzimidazol-2-ylidene]-1,2-dihydroindazol-4-yl]acetamide Traditional Name: N-[(3Z)-3-[5-(4-methylpiperazino)benzimidazol-2-ylidene]indazolin-4-yl]acetamide Formula: C21H23N7O MolecularWeight: 389.45362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC2=C1C(=C3N=C4C=CC(=CC4=N3)N5CCN(CC5)C)NN2

Isomeric SMILES

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

InChI

InChI=1S/C21H23N7O/c1-13(29)22-16-4-3-5-17-19(16)20(26-25-17)21-23-15-7-6-14(12-18(15)24-21)28-10-8-27(2)9-11-28/h3-7,12,25-26H,8-11H2,1-2H3,(H,22,29)/b21-20-