2-(9-METHYL-6-OXO-5,6-DIHYDRO-7H-PYRROLO[1,2-A][3,1,6]BENZOTHIADIAZOCIN-7-YL)BUTANOIC ACID

pro_cas
pro_cdbregno
CCD03263452
pro_formula
C17 H18 N2 O3 S
pro_molWeight
330.406

basic_info

Product_Name: 2-(9-METHYL-6-OXO-5,6-DIHYDRO-7H-PYRROLO[1,2-A][3,1,6]BENZOTHIADIAZOCIN-7-YL)BUTANOIC ACID
EnglishSynonyms: 2-(9-METHYL-6-OXO-5,6-DIHYDRO-7H-PYRROLO[1,2-A][3,1,6]BENZOTHIADIAZOCIN-7-YL)BUTANOIC ACID
pro_mdlNumber: MFCD16991739
pro_acceptors: 5
pro_donors: 1
pro_smile: CCC(C(=O)O)N1c2cc(ccc2-n3cccc3SCC1=O)C
InChi: InChI=1S/C17H18N2O3S/c1-3-12(17(21)22)19-14-9-11(2)6-7-13(14)18-8-4-5-16(18)23-10-15(19)20/h4-9,12H,3,10H2,1-2H3,(H,21,22)
InChiKey: InChIKey=QIHPEOLGGSXABL-UHFFFAOYSA-N

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