4-[4-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]piperazin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[4-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]piperazin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[4-[(2-bromo-4,5-dimethoxy-phenyl)methyl]piperazin-1-yl]sulfonyl-3,5-dimethyl-isoxazole CAS Name: 4-[[4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-piperazinyl]sulfonyl]-3,5-dimethylisoxazole IUPAC Name: 4-[4-[(2-bromo-4,5-dimethoxyphenyl)methyl]piperazin-1-yl]sulfonyl-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[4-(2-bromo-4,5-dimethoxy-benzyl)piperazino]sulfonyl-3,5-dimethyl-isoxazole Formula: C18H24BrN3O5S MolecularWeight: 474.36926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C18H24BrN3O5S/c1-12-18(13(2)27-20-12)28(23,24)22-7-5-21(6-8-22)11-14-9-16(25-3)17(26-4)10-15(14)19/h9-10H,5-8,11H2,1-4H3