Free release

EXP 631

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Name: EXP 631
CAS: 151656-58-5
Synonyms: EXP 631
MDL.: MFCD00923837
H bond acceptor: 2
H bond donor: 1
Smile: CC(C)(C1(CCN(CC1)C)c2ccsc2)O.C(=C/C(=O)O)\C(=O)O
InChi: InChI=1S/C13H21NOS.C4H4O4/c1-12(2,15)13(11-4-9-16-10-11)5-7-14(3)8-6-13;5-3(6)1-2-4(7)8/h4,9-10,15H,5-8H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChiKey: InChIKey=UPIVEKIRCYVMLE-WLHGVMLRSA-N

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