[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-(7-chloranyl-1,3-benzodioxol-5-yl)methanone

Systemtic Name: [4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-(7-chloranyl-1,3-benzodioxol-5-yl)methanone Openeye Name: [4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-(7-chloro-1,3-benzodioxol-5-yl)methanone CAS Name: [4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-(7-chloro-1,3-benzodioxol-5-yl)methanone IUPAC Name: [4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-(7-chloro-1,3-benzodioxol-5-yl)methanone Traditional Name: [4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-(7-chloro-1,3-benzodioxol-5-yl)methanone Formula: C16H14BrClN2O5S2 MolecularWeight: 493.77976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C(=C2)Cl)OCO3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C(=C2)Cl)OCO3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C16H14BrClN2O5S2/c17-13-1-2-14(26-13)27(22,23)20-5-3-19(4-6-20)16(21)10-7-11(18)15-12(8-10)24-9-25-15/h1-2,7-8H,3-6,9H2