4-azido-N-[(E)-3-(4,4-dimethoxybutylamino)-3-oxidanylidene-1-pyridin-3-yl-prop-1-en-2-yl]benzamide

Systemtic Name: 4-azido-N-[(E)-3-(4,4-dimethoxybutylamino)-3-oxidanylidene-1-pyridin-3-yl-prop-1-en-2-yl]benzamide Openeye Name: 4-azido-N-[(E)-1-(4,4-dimethoxybutylcarbamoyl)-2-(3-pyridyl)vinyl]benzamide CAS Name: 4-azido-N-[(E)-3-(4,4-dimethoxybutylamino)-3-oxo-1-(3-pyridinyl)prop-1-en-2-yl]benzamide IUPAC Name: 4-azido-N-[(E)-3-(4,4-dimethoxybutylamino)-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide Traditional Name: 4-azido-N-[(E)-1-(4,4-dimethoxybutylcarbamoyl)-2-(3-pyridyl)vinyl]benzamide Formula: C21H24N6O4 MolecularWeight: 424.45306

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Descriptors Computed from Structure

Canonical SMILES:

COC(CCCNC(=O)C(=CC1=CN=CC=C1)NC(=O)C2=CC=C(C=C2)N=[N+]=[N-])OC

Isomeric SMILES

COC(CCCNC(=O)/C(=C\C1=CN=CC=C1)/NC(=O)C2=CC=C(C=C2)N=[N+]=[N-])OC

InChI

InChI=1S/C21H24N6O4/c1-30-19(31-2)6-4-12-24-21(29)18(13-15-5-3-11-23-14-15)25-20(28)16-7-9-17(10-8-16)26-27-22/h3,5,7-11,13-14,19H,4,6,12H2,1-2H3,(H,24,29)(H,25,28)/b18-13+