5-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]thiophene-2-carbaldehyde

Systemtic Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]thiophene-2-carbaldehyde Openeye Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]thiophene-2-carbaldehyde CAS Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-2-thiophenecarboxaldehyde IUPAC Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]thiophene-2-carbaldehyde Traditional Name: 5-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]thiophene-2-carbaldehyde Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(S2)C=O)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCN1C2=CC=C(S2)C=O)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C17H18N2O5S2/c20-12-13-1-4-17(25-13)18-5-7-19(8-6-18)26(21,22)14-2-3-15-16(11-14)24-10-9-23-15/h1-4,11-12H,5-10H2