N-[3-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]ethanamide

Systemtic Name: N-[3-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]ethanamide Openeye Name: N-[3-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-oxo-1-phenyl-propyl]acetamide CAS Name: N-[3-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-3-oxo-1-phenylpropyl]acetamide IUPAC Name: N-[3-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-oxo-1-phenylpropyl]acetamide Traditional Name: N-[3-(4-brosylpiperazino)-3-keto-1-phenyl-propyl]acetamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

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