7H-1,2,4-TRIAZOLO(3,4-B)(1,3,4)THIADIAZINE-7-ACETIC ACID, 3-(1,3-BENZO DIOXOL-5-YL)-6-(4-CHLOROPHENYL)-

pro_cas
126598-25-2
pro_cdbregno
CCD00238895
pro_formula
C19 H13 Cl N4 O4 S
pro_molWeight
428.855

basic_info

Product_Name: 7H-1,2,4-TRIAZOLO(3,4-B)(1,3,4)THIADIAZINE-7-ACETIC ACID, 3-(1,3-BENZO DIOXOL-5-YL)-6-(4-CHLOROPHENYL)-
CAS: 126598-25-2
EnglishSynonyms: 7H-1,2,4-TRIAZOLO(3,4-B)(1,3,4)THIADIAZINE-7-ACETIC ACID, 3-(1,3-BENZO DIOXOL-5-YL)-6-(4-CHLOROPHENYL)-
pro_mdlNumber: MFCD01678098
pro_acceptors: 8
pro_donors: 1
pro_smile: c1cc(ccc1C2=Nn3c(nnc3SC2CC(=O)O)c4ccc5c(c4)OCO5)Cl
InChi: InChI=1S/C19H13ClN4O4S/c20-12-4-1-10(2-5-12)17-15(8-16(25)26)29-19-22-21-18(24(19)23-17)11-3-6-13-14(7-11)28-9-27-13/h1-7,15H,8-9H2,(H,25,26)
InChiKey: InChIKey=NHIXWUWATNTKLN-UHFFFAOYSA-N

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