[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(4-methoxyphenyl)methanone Openeye Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(4-methoxyphenyl)methanone CAS Name: [4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-(4-methoxyphenyl)methanone IUPAC Name: [4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]-(4-methoxyphenyl)methanone Traditional Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]-(4-methoxyphenyl)methanone Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C19H21BrN2O4S/c1-14-13-17(7-8-18(14)20)27(24,25)22-11-9-21(10-12-22)19(23)15-3-5-16(26-2)6-4-15/h3-8,13H,9-12H2,1-2H3