(3E)-3-[5-[(3-azanylpropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile

Systemtic Name: (3E)-3-[5-[(3-azanylpropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile Openeye Name: (3E)-3-[5-[(3-aminopropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile CAS Name: (3E)-3-[5-[(3-aminopropylamino)methyl]-2-indolylidene]-1,2-dihydroindazole-6-carbonitrile IUPAC Name: (3E)-3-[5-[(3-aminopropylamino)methyl]indol-2-ylidene]-1,2-dihydroindazole-6-carbonitrile Traditional Name: (3E)-3-[5-[(3-aminopropylamino)methyl]indol-2-ylidene]indazoline-6-carbonitrile Formula: C20H20N6 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=C3C4=C(C=C(C=C4)C#N)NN3)C=C2C=C1CNCCCN

Isomeric SMILES

C1=CC2=N/C(=C/3\C4=C(C=C(C=C4)C#N)NN3)/C=C2C=C1CNCCCN

InChI

InChI=1S/C20H20N6/c21-6-1-7-23-12-14-3-5-17-15(8-14)10-19(24-17)20-16-4-2-13(11-22)9-18(16)25-26-20/h2-5,8-10,23,25-26H,1,6-7,12,21H2/b20-19+