4-bromanyl-N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-bromo-N-[3-oxo-3-[4-(p-tolylsulfonyl)piperazin-1-yl]propyl]benzamide CAS Name: 4-bromo-N-[3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]benzamide IUPAC Name: 4-bromo-N-[3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]benzamide Traditional Name: 4-bromo-N-[3-keto-3-(4-tosylpiperazino)propyl]benzamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H24BrN3O4S/c1-16-2-8-19(9-3-16)30(28,29)25-14-12-24(13-15-25)20(26)10-11-23-21(27)17-4-6-18(22)7-5-17/h2-9H,10-15H2,1H3,(H,23,27)