4,5-dimethyl-6-pyridin-4-yl-1,4-thiazin-3-one; 4-methylbenzenesulfonic acid

Systemtic Name: 4,5-dimethyl-6-pyridin-4-yl-1,4-thiazin-3-one; 4-methylbenzenesulfonic acid Openeye Name: 4,5-dimethyl-6-(4-pyridyl)-1,4-thiazin-3-one; 4-methylbenzenesulfonic acid CAS Name: 4,5-dimethyl-6-pyridin-4-yl-1,4-thiazin-3-one; 4-methylbenzenesulfonic acid IUPAC Name: 4,5-dimethyl-6-pyridin-4-yl-1,4-thiazin-3-one; 4-methylbenzenesulfonic acid Traditional Name: 4,5-dimethyl-6-(4-pyridyl)-1,4-thiazin-3-one; tosylic acid Formula: C18H20N2O4S2 MolecularWeight: 392.4924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=C(SCC(=O)N1C)C2=CC=NC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC1=C(SCC(=O)N1C)C2=CC=NC=C2

InChI

InChI=1S/C11H12N2OS.C7H8O3S/c1-8-11(9-3-5-12-6-4-9)15-7-10(14)13(8)2;1-6-2-4-7(5-3-6)11(8,9)10/h3-6H,7H2,1-2H3;2-5H,1H3,(H,8,9,10)