[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2,5-dimethylthiophen-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2,5-dimethylthiophen-3-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2,5-dimethyl-3-thienyl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(2,5-dimethyl-3-thiophenyl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2,5-dimethylthiophen-3-yl)methanone Traditional Name: (4-brosylpiperazino)-(2,5-dimethyl-3-thienyl)methanone Formula: C17H19BrN2O3S2 MolecularWeight: 443.37836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H19BrN2O3S2/c1-12-11-16(13(2)24-12)17(21)19-7-9-20(10-8-19)25(22,23)15-5-3-14(18)4-6-15/h3-6,11H,7-10H2,1-2H3