N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]thiophene-2-sulfonamide

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]thiophene-2-sulfonamide Openeye Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]thiophene-2-sulfonamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-2-thiophenesulfonamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]thiophene-2-sulfonamide Traditional Name: N-[2-keto-2-(4-piperonylpiperazino)ethyl]thiophene-2-sulfonamide Formula: C18H21N3O5S2 MolecularWeight: 423.50644

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CNS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CNS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H21N3O5S2/c22-17(11-19-28(23,24)18-2-1-9-27-18)21-7-5-20(6-8-21)12-14-3-4-15-16(10-14)26-13-25-15/h1-4,9-10,19H,5-8,11-13H2