2-(2,3-DIHYDRO-1H-8-THIA-5,7-DIAZA-CYCLOPENTA[A]INDEN-4-YLSULFANYL)-BENZOIC ACID

pro_cas
554407-97-5
pro_cdbregno
CCD00436258
pro_formula
C16 H12 N2 O2 S2
pro_molWeight
328.415

basic_info

Product_Name: 2-(2,3-DIHYDRO-1H-8-THIA-5,7-DIAZA-CYCLOPENTA[A]INDEN-4-YLSULFANYL)-BENZOIC ACID
CAS: 554407-97-5
EnglishSynonyms: 2-(2,3-DIHYDRO-1H-8-THIA-5,7-DIAZA-CYCLOPENTA[A]INDEN-4-YLSULFANYL)-BENZOIC ACID
pro_mdlNumber: MFCD03973224
pro_acceptors: 4
pro_donors: 1
pro_smile: c1ccc(c(c1)C(=O)O)Sc2c3c4c(sc3ncn2)CCC4
InChi: InChI=1S/C16H12N2O2S2/c19-16(20)10-4-1-2-6-12(10)22-15-13-9-5-3-7-11(9)21-14(13)17-8-18-15/h1-2,4,6,8H,3,5,7H2,(H,19,20)
InChiKey: InChIKey=QFTBUYQYYPLHDV-UHFFFAOYSA-N

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