4-bromanyl-N-[(2S)-1-oxidanylidene-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propan-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[(2S)-1-oxidanylidene-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propan-2-yl]benzamide Openeye Name: 4-bromo-N-[(1S)-1-methyl-2-oxo-2-[4-(4-pyridylmethyl)piperazin-1-yl]ethyl]benzamide CAS Name: 4-bromo-N-[(2S)-1-oxo-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]propan-2-yl]benzamide IUPAC Name: 4-bromo-N-[(2S)-1-oxo-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]propan-2-yl]benzamide Traditional Name: 4-bromo-N-[(1S)-2-keto-1-methyl-2-[4-(4-pyridylmethyl)piperazino]ethyl]benzamide Formula: C20H23BrN4O2 MolecularWeight: 431.32622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)CC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN4O2/c1-15(23-19(26)17-2-4-18(21)5-3-17)20(27)25-12-10-24(11-13-25)14-16-6-8-22-9-7-16/h2-9,15H,10-14H2,1H3,(H,23,26)/t15-/m0/s1