N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-imidazol-1-yl-ethanamide

Systemtic Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-imidazol-1-yl-ethanamide Openeye Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-imidazol-1-yl-acetamide CAS Name: N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]phenyl]-2-(1-imidazolyl)acetamide IUPAC Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-imidazol-1-ylacetamide Traditional Name: 2-imidazol-1-yl-N-[3-(4-piperonylpiperazino)sulfonylphenyl]acetamide Formula: C23H25N5O5S MolecularWeight: 483.5401

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC(=C4)NC(=O)CN5C=CN=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC(=C4)NC(=O)CN5C=CN=C5

InChI

InChI=1S/C23H25N5O5S/c29-23(15-27-7-6-24-16-27)25-19-2-1-3-20(13-19)34(30,31)28-10-8-26(9-11-28)14-18-4-5-21-22(12-18)33-17-32-21/h1-7,12-13,16H,8-11,14-15,17H2,(H,25,29)