methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: methyl-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: methyl-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [2-keto-2-(4-mesylpiperazino)ethyl]-methyl-(2-thenyl)ammonium Formula: C13H22N3O3S2+ MolecularWeight: 332.46208

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CS1)CC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

C[NH+](CC1=CC=CS1)CC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H21N3O3S2/c1-14(10-12-4-3-9-20-12)11-13(17)15-5-7-16(8-6-15)21(2,18)19/h3-4,9H,5-8,10-11H2,1-2H3/p+1