N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]pyridine-3-carboxamide

Systemtic Name: N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]pyridine-3-carboxamide Openeye Name: N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxo-indolin-3-ylidene]amino]pyridine-3-carboxamide CAS Name: N-[(E)-[1-[(4-methyl-1-piperazin-4-iumyl)methyl]-2-oxo-3-indolylidene]amino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-oxoindol-3-ylidene]amino]pyridine-3-carboxamide Traditional Name: N-[(E)-[2-keto-1-[(4-methylpiperazin-4-ium-1-yl)methyl]indolin-3-ylidene]amino]nicotinamide Formula: C20H23N6O2+ MolecularWeight: 379.43562

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CN2C3=CC=CC=C3C(=NNC(=O)C4=CN=CC=C4)C2=O

Isomeric SMILES

C[NH+]1CCN(CC1)CN2C3=CC=CC=C3/C(=N\NC(=O)C4=CN=CC=C4)/C2=O

InChI

InChI=1S/C20H22N6O2/c1-24-9-11-25(12-10-24)14-26-17-7-3-2-6-16(17)18(20(26)28)22-23-19(27)15-5-4-8-21-13-15/h2-8,13H,9-12,14H2,1H3,(H,23,27)/p+1/b22-18+