N-[(E)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-3-oxidanylidene-1-pyridin-3-yl-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-3-oxidanylidene-1-pyridin-3-yl-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-1-[(4-methylpiperazin-4-ium-1-yl)carbamoyl]-2-(3-pyridyl)vinyl]benzamide CAS Name: N-[(E)-3-[(4-methyl-1-piperazin-4-iumyl)amino]-3-oxo-1-(3-pyridinyl)prop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-1-[(4-methylpiperazin-4-ium-1-yl)carbamoyl]-2-(3-pyridyl)vinyl]benzamide Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C(=CC2=CN=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O2/c1-24-10-12-25(13-11-24)23-20(27)18(14-16-6-5-9-21-15-16)22-19(26)17-7-3-2-4-8-17/h2-9,14-15H,10-13H2,1H3,(H,22,26)(H,23,27)/p+1/b18-14+