1-(1,3-benzodioxol-5-ylmethyl)-4-(1,3-dimethylpyrazol-4-yl)sulfonyl-piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1,3-dimethylpyrazol-4-yl)sulfonyl-piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1,3-dimethylpyrazol-4-yl)sulfonyl-piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(1,3-dimethyl-4-pyrazolyl)sulfonyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1,3-dimethylpyrazol-4-yl)sulfonylpiperazine Traditional Name: 1-(1,3-dimethylpyrazol-4-yl)sulfonyl-4-piperonyl-piperazine Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C17H22N4O4S/c1-13-17(11-19(2)18-13)26(22,23)21-7-5-20(6-8-21)10-14-3-4-15-16(9-14)25-12-24-15/h3-4,9,11H,5-8,10,12H2,1-2H3