4-bromanyl-N-[(E)-[4-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-butan-2-ylidene]amino]benzamide

Systemtic Name: 4-bromanyl-N-[(E)-[4-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-butan-2-ylidene]amino]benzamide Openeye Name: 4-bromo-N-[(E)-[3-(4-formylpiperazin-1-yl)-1-methyl-3-oxo-propylidene]amino]benzamide CAS Name: 4-bromo-N-[(E)-[4-(4-formyl-1-piperazinyl)-4-oxobutan-2-ylidene]amino]benzamide IUPAC Name: 4-bromo-N-[(E)-[4-(4-formylpiperazin-1-yl)-4-oxobutan-2-ylidene]amino]benzamide Traditional Name: 4-bromo-N-[(E)-[3-(4-formylpiperazino)-3-keto-1-methyl-propylidene]amino]benzamide Formula: C16H19BrN4O3 MolecularWeight: 395.25106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)Br)CC(=O)N2CCN(CC2)C=O

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)Br)/CC(=O)N2CCN(CC2)C=O

InChI

InChI=1S/C16H19BrN4O3/c1-12(10-15(23)21-8-6-20(11-22)7-9-21)18-19-16(24)13-2-4-14(17)5-3-13/h2-5,11H,6-10H2,1H3,(H,19,24)/b18-12+