5-morpholin-4-ylsulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyridin-1-ium-2-amine

Systemtic Name: 5-morpholin-4-ylsulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyridin-1-ium-2-amine Openeye Name: 5-morpholinosulfonyl-N-[2-(2-thienylmethylsulfanyl)ethyl]pyridin-1-ium-2-amine CAS Name: 5-(4-morpholinylsulfonyl)-N-[2-(thiophen-2-ylmethylthio)ethyl]-2-pyridin-1-iumamine IUPAC Name: 5-morpholin-4-ylsulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyridin-1-ium-2-amine Traditional Name: (5-morpholinosulfonylpyridin-1-ium-2-yl)-[2-(2-thenylthio)ethyl]amine Formula: C16H22N3O3S3+ MolecularWeight: 400.55918

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C[NH+]=C(C=C2)NCCSCC3=CC=CS3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C[NH+]=C(C=C2)NCCSCC3=CC=CS3

InChI

InChI=1S/C16H21N3O3S3/c20-25(21,19-6-8-22-9-7-19)15-3-4-16(18-12-15)17-5-11-23-13-14-2-1-10-24-14/h1-4,10,12H,5-9,11,13H2,(H,17,18)/p+1