1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-thiophen-2-ylsulfonyl-piperazine

Systemtic Name: 1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-thiophen-2-ylsulfonyl-piperazine Openeye Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-(2-thienylsulfonyl)piperazine CAS Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-thiophen-2-ylsulfonylpiperazine IUPAC Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-thiophen-2-ylsulfonylpiperazine Traditional Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-(2-thienylsulfonyl)piperazine Formula: C17H19ClN2O4S2 MolecularWeight: 414.92676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C3C(=CC(=C2)Cl)COCO3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=C3C(=CC(=C2)Cl)COCO3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H19ClN2O4S2/c18-15-8-13(17-14(9-15)11-23-12-24-17)10-19-3-5-20(6-4-19)26(21,22)16-2-1-7-25-16/h1-2,7-9H,3-6,10-12H2