N-[4-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]thiazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-2-thiazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[2-keto-2-(4-mesylpiperazino)ethyl]thiazol-2-yl]-piperonylamide Formula: C18H20N4O6S2 MolecularWeight: 452.5046

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CC2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CC2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H20N4O6S2/c1-30(25,26)22-6-4-21(5-7-22)16(23)9-13-10-29-18(19-13)20-17(24)12-2-3-14-15(8-12)28-11-27-14/h2-3,8,10H,4-7,9,11H2,1H3,(H,19,20,24)