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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CN2C=C(C=CC2=S)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)CN2C=C(C=CC2=S)S(=O)(=O)N3CCOCC3

InChI

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