5,6,7,7A-TETRAHYDROTHIENO[3,2-C]PYRIDIN-2(4H)-ONE 4-METHYLBENZENESULFONATE

CAS No.
952340-39-5 ;178688-49-8
CCD No.
CCD01572702
Formula
C7 H9 N O S . C7 H8 O3 S
MolWeight
327.423

Basic Information

Product Name: 5,6,7,7A-TETRAHYDROTHIENO[3,2-C]PYRIDIN-2(4H)-ONE 4-METHYLBENZENESULFONATE
CAS: 952340-39-5 ;178688-49-8
English Synonyms: 5,6,7,7A-TETRAHYDROTHIENO[3,2-C]PYRIDIN-2(4H)-ONE P-TOLUENESULFONATE ; 5,6,7,7A-TETRAHYDROTHIENO[3,2-C]PYRIDIN-2(4H)-ONE 4-METHYLBENZENESULFONATE ; THIENO[3,2-C]PYRIDIN-2(4H)-ONE, 5,6,7,7A-TETRAHYDRO-, 4-METHYLBENZENESULFONATE (1:1) ; 5,6,7,7A-TETRAHYDROTHIENO[3,2-C]PYRIDINE-2(4H)-ONE PARA-TOLUENESULFONIC ACID SALT
MDL Number.: MFCD12407185
H bond acceptor: 3
H bond donor: 1
Smile: Cc1ccc(cc1)S(=O)(=O)O.C1CNCC2=CC(=O)SC21
InChi: InChI=1S/C7H9NOS.C7H8O3S/c9-7-3-5-4-8-2-1-6(5)10-7;1-6-2-4-7(5-3-6)11(8,9)10/h3,6,8H,1-2,4H2;2-5H,1H3,(H,8,9,10)
InChiKey: InChIKey=FQNGDMMHUSPFOL-UHFFFAOYSA-N

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