(5-bromanylthiophen-2-yl)-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (5-bromanylthiophen-2-yl)-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-bromo-2-thienyl)-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (5-bromo-2-thiophenyl)-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-bromothiophen-2-yl)-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (5-bromo-2-thienyl)-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]methanone Formula: C17H19BrN2O5S2 MolecularWeight: 475.37716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)Br)OC

InChI

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