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

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]methanone CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]methanone Formula: C17H19BrN2O5S2 MolecularWeight: 475.37716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)Br)O)OC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)Br)O)OC

InChI

InChI=1S/C17H19BrN2O5S2/c1-11-3-4-15(26-11)27(23,24)20-7-5-19(6-8-20)17(22)12-9-13(18)16(21)14(10-12)25-2/h3-4,9-10,21H,5-8H2,1-2H3