3-[2-OXO-6-(PROPAN-2-YL)-2,3,4,5,6,7-HEXAHYDRO-1,3-BENZOTHIAZOL-3-YL]PROPANOIC ACID

CAS No.
CCD No.
CCD03381914
Formula
C13 H19 N O3 S
MolWeight
269.363

Basic Information

Product Name: 3-[2-OXO-6-(PROPAN-2-YL)-2,3,4,5,6,7-HEXAHYDRO-1,3-BENZOTHIAZOL-3-YL]PROPANOIC ACID
English Synonyms: 3-[2-OXO-6-(PROPAN-2-YL)-2,3,4,5,6,7-HEXAHYDRO-1,3-BENZOTHIAZOL-3-YL]PROPANOIC ACID
MDL Number.: MFCD17114954
H bond acceptor: 4
H bond donor: 1
Smile: CC(C)C1CCc2c(sc(=O)n2CCC(=O)O)C1
InChi: InChI=1S/C13H19NO3S/c1-8(2)9-3-4-10-11(7-9)18-13(17)14(10)6-5-12(15)16/h8-9H,3-7H2,1-2H3,(H,15,16)
InChiKey: InChIKey=VNEBABJTDVFXON-UHFFFAOYSA-N

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