6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-1,3-dimethyl-quinazoline-2,4-dione

Systemtic Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-1,3-dimethyl-quinazoline-2,4-dione Openeye Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-1,3-dimethyl-quinazoline-2,4-dione CAS Name: 6-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]-1,3-dimethylquinazoline-2,4-dione IUPAC Name: 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-1,3-dimethylquinazoline-2,4-dione Traditional Name: 1,3-dimethyl-6-(4-piperonylpiperazino)sulfonyl-quinazoline-2,4-quinone Formula: C22H24N4O6S MolecularWeight: 472.51416

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C(=O)N(C1=O)C

InChI

InChI=1S/C22H24N4O6S/c1-23-18-5-4-16(12-17(18)21(27)24(2)22(23)28)33(29,30)26-9-7-25(8-10-26)13-15-3-6-19-20(11-15)32-14-31-19/h3-6,11-12H,7-10,13-14H2,1-2H3