[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(5-chloranyl-2-methoxy-phenyl)methanone

Systemtic Name: [4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(5-chloranyl-2-methoxy-phenyl)methanone Openeye Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-yl]-(5-chloro-2-methoxy-phenyl)methanone CAS Name: [4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazinyl]-(5-chloro-2-methoxyphenyl)methanone IUPAC Name: [4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-yl]-(5-chloro-2-methoxyphenyl)methanone Traditional Name: [4-(4-bromo-3-methyl-phenyl)sulfonylpiperazino]-(5-chloro-2-methoxy-phenyl)methanone Formula: C19H20BrClN2O4S MolecularWeight: 487.7951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrClN2O4S/c1-13-11-15(4-5-17(13)20)28(25,26)23-9-7-22(8-10-23)19(24)16-12-14(21)3-6-18(16)27-2/h3-6,11-12H,7-10H2,1-2H3