N-[4-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]-4-chloranyl-benzamide

Systemtic Name: N-[4-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]-4-chloranyl-benzamide Openeye Name: N-[4-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-4-oxo-butyl]-4-chloro-benzamide CAS Name: N-[4-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-4-oxobutyl]-4-chlorobenzamide IUPAC Name: N-[4-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-4-oxobutyl]-4-chlorobenzamide Traditional Name: N-[4-[4-(5-bromopyrimidin-2-yl)piperazino]-4-keto-butyl]-4-chloro-benzamide Formula: C19H21BrClN5O2 MolecularWeight: 466.75934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)CCCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)Br)C(=O)CCCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H21BrClN5O2/c20-15-12-23-19(24-13-15)26-10-8-25(9-11-26)17(27)2-1-7-22-18(28)14-3-5-16(21)6-4-14/h3-6,12-13H,1-2,7-11H2,(H,22,28)