(3E)-3-[4-[(4-ethanoylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile

Systemtic Name: (3E)-3-[4-[(4-ethanoylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile Openeye Name: (3E)-3-[4-[(4-acetylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile CAS Name: (3E)-3-[4-[(4-acetyl-1-piperazinyl)methyl]-2-indolylidene]-1,2-dihydroindazole-6-carbonitrile IUPAC Name: (3E)-3-[4-[(4-acetylpiperazin-1-yl)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile Traditional Name: (3E)-3-[4-[(4-acetylpiperazino)methyl]indol-2-ylidene]indazoline-6-carbonitrile Formula: C23H22N6O MolecularWeight: 398.46038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=CC=CC3=NC(=C4C5=C(C=C(C=C5)C#N)NN4)C=C32

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=CC=CC3=N/C(=C/4\C5=C(C=C(C=C5)C#N)NN4)/C=C32

InChI

InChI=1S/C23H22N6O/c1-15(30)29-9-7-28(8-10-29)14-17-3-2-4-20-19(17)12-22(25-20)23-18-6-5-16(13-24)11-21(18)26-27-23/h2-6,11-12,26-27H,7-10,14H2,1H3/b23-22+