N-(2-bromophenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2-bromophenyl)-2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2-bromophenyl)-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2-bromophenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(2-bromophenyl)-2-(4-p-cumenylsulfonylpiperazino)acetamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C21H26BrN3O3S/c1-16(2)17-7-9-18(10-8-17)29(27,28)25-13-11-24(12-14-25)15-21(26)23-20-6-4-3-5-19(20)22/h3-10,16H,11-15H2,1-2H3,(H,23,26)