3-(2-MORPHOLINO-THIEN-2YL)-5-(2,5-DIHYDRO-4-METHYL-2-MORPHOLIN-1-YLIDENE-ONIUM-THIEN-5-YLIDENE)-1,2-DIOXO-CYCLOPENTEN-4-OLATE

pro_cas
139255-43-9
pro_cdbregno
CCD00166016
pro_formula
C22 H22 N2 O5 S2
pro_molWeight
458.557

basic_info

Product_Name: 3-(2-MORPHOLINO-THIEN-2YL)-5-(2,5-DIHYDRO-4-METHYL-2-MORPHOLIN-1-YLIDENE-ONIUM-THIEN-5-YLIDENE)-1,2-DIOXO-CYCLOPENTEN-4-OLATE
CAS: 139255-43-9
EnglishSynonyms: 3-(2-MORPHOLINO-THIEN-2YL)-5-(2,5-DIHYDRO-4-METHYL-2-MORPHOLIN-1-YLIDENE-ONIUM-THIEN-5-YLIDENE)-1,2-DIOXO-CYCLOPENTEN-4-OLATE
pro_mdlNumber: MFCD00799452
pro_acceptors: 7
pro_donors: 0
pro_smile: CC1=C/C(=C/2\C(=C(C(=O)C2=O)c3ccc(s3)N4CCOCC4)[O-])/SC1=[N+]5CCOCC5
InChi: InChI=1S/C22H22N2O5S2/c1-13-12-15(31-22(13)24-6-10-29-11-7-24)18-19(25)17(20(26)21(18)27)14-2-3-16(30-14)23-4-8-28-9-5-23/h2-3,12H,4-11H2,1H3
InChiKey: InChIKey=VJTZMEDGRFGCQL-UHFFFAOYSA-N

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