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

Systemtic Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]propanoylamino]thiophene-3-carboxamide Formula: C20H24N4O6S2 MolecularWeight: 480.55776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C(=O)NC1=C(C=CS1)C(=O)N)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H24N4O6S2/c1-13(19(26)22-20-15(18(21)25)4-11-31-20)23-5-7-24(8-6-23)32(27,28)14-2-3-16-17(12-14)30-10-9-29-16/h2-4,11-13H,5-10H2,1H3,(H2,21,25)(H,22,26)