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

Systemtic Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-(1,2,4-triazol-1-yl)ethanamide Openeye Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-(1,2,4-triazol-1-yl)acetamide CAS Name: N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]phenyl]-2-(1,2,4-triazol-1-yl)acetamide IUPAC Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonylphenyl]-2-(1,2,4-triazol-1-yl)acetamide Traditional Name: N-[3-(4-piperonylpiperazino)sulfonylphenyl]-2-(1,2,4-triazol-1-yl)acetamide Formula: C22H24N6O5S MolecularWeight: 484.52816

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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=NC=N5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CC(=C4)NC(=O)CN5C=NC=N5

InChI

InChI=1S/C22H24N6O5S/c29-22(13-27-15-23-14-24-27)25-18-2-1-3-19(11-18)34(30,31)28-8-6-26(7-9-28)12-17-4-5-20-21(10-17)33-16-32-20/h1-5,10-11,14-15H,6-9,12-13,16H2,(H,25,29)