ethyl-[(5-morpholin-4-ylsulfonyl-2-sulfanylidene-pyridin-1-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[(5-morpholin-4-ylsulfonyl-2-sulfanylidene-pyridin-1-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[(5-morpholinosulfonyl-2-thioxo-1-pyridyl)methyl]ammonium CAS Name: ethyl-[[5-(4-morpholinylsulfonyl)-2-sulfanylidene-1-pyridinyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[(5-morpholin-4-ylsulfonyl-2-sulfanylidenepyridin-1-yl)methyl]azanium Traditional Name: benzyl-ethyl-[(5-morpholinosulfonyl-2-thioxo-1-pyridyl)methyl]ammonium Formula: C19H26N3O3S2+ MolecularWeight: 408.55804

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CN2C=C(C=CC2=S)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CN2C=C(C=CC2=S)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H25N3O3S2/c1-2-20(14-17-6-4-3-5-7-17)16-21-15-18(8-9-19(21)26)27(23,24)22-10-12-25-13-11-22/h3-9,15H,2,10-14,16H2,1H3/p+1