1-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-thiophen-2-ylsulfonyl-piperazine

Systemtic Name: 1-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-thiophen-2-ylsulfonyl-piperazine Openeye Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(2-thienylsulfonyl)piperazine CAS Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-thiophen-2-ylsulfonylpiperazine IUPAC Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-thiophen-2-ylsulfonylpiperazine Traditional Name: 1-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-4-(2-thienylsulfonyl)piperazine Formula: C17H19BrN2O4S2 MolecularWeight: 459.37776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H19BrN2O4S2/c18-14-11-16-15(23-7-8-24-16)10-13(14)12-19-3-5-20(6-4-19)26(21,22)17-2-1-9-25-17/h1-2,9-11H,3-8,12H2