N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-methyl-N-[(5-methyl-2-furanyl)methyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C17H24N3O4S2+ MolecularWeight: 398.52016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H23N3O4S2/c1-14-5-6-15(24-14)12-18(2)16(21)13-19-7-9-20(10-8-19)26(22,23)17-4-3-11-25-17/h3-6,11H,7-10,12-13H2,1-2H3/p+1