N-(4-bromanyl-3-methyl-phenyl)-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]methanesulfonamide CAS Name: N-(4-bromo-3-methylphenyl)-N-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]methanesulfonamide IUPAC Name: N-(4-bromo-3-methylphenyl)-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]methanesulfonamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-N-[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethyl]methanesulfonamide Formula: C21H26BrN3O4S MolecularWeight: 496.41784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26BrN3O4S/c1-16-14-18(6-9-20(16)22)25(30(3,27)28)15-21(26)24-12-10-23(11-13-24)17-4-7-19(29-2)8-5-17/h4-9,14H,10-13,15H2,1-3H3