N-[3-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: N-[3-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: N-[3-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: N-[3-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: N-[3-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: N-[3-[4-(5-bromopyrimidin-2-yl)piperazino]-3-keto-propyl]benzenesulfonamide Formula: C17H20BrN5O3S MolecularWeight: 454.3414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20BrN5O3S/c18-14-12-19-17(20-13-14)23-10-8-22(9-11-23)16(24)6-7-21-27(25,26)15-4-2-1-3-5-15/h1-5,12-13,21H,6-11H2