[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(5-methoxy-3-methyl-benzofuran-2-yl)methanone CAS Name: [4-(4-bromophenyl)sulfonyl-1-piperazinyl]-(5-methoxy-3-methyl-2-benzofuranyl)methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(5-methoxy-3-methyl-1-benzofuran-2-yl)methanone Traditional Name: (4-brosylpiperazino)-(5-methoxy-3-methyl-benzofuran-2-yl)methanone Formula: C21H21BrN2O5S MolecularWeight: 493.37084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H21BrN2O5S/c1-14-18-13-16(28-2)5-8-19(18)29-20(14)21(25)23-9-11-24(12-10-23)30(26,27)17-6-3-15(22)4-7-17/h3-8,13H,9-12H2,1-2H3