4-bromanyl-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]benzamide Openeye Name: 4-bromo-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]benzamide CAS Name: 4-bromo-N-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 4-bromo-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylpropyl]benzamide Traditional Name: 4-bromo-N-[3-[4-(4-methoxyphenyl)piperazino]sulfonylpropyl]benzamide Formula: C21H26BrN3O4S MolecularWeight: 496.41784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)CCCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)CCCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H26BrN3O4S/c1-29-20-9-7-19(8-10-20)24-12-14-25(15-13-24)30(27,28)16-2-11-23-21(26)17-3-5-18(22)6-4-17/h3-10H,2,11-16H2,1H3,(H,23,26)