4-(2-((CYCLOHEXYLAMINO)CARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE

pro_cas
pro_cdbregno
CCD00355925
pro_formula
C21 H22 Cl N3 O2 S
pro_molWeight
415.943

basic_info

Product_Name: 4-(2-((CYCLOHEXYLAMINO)CARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
EnglishSynonyms: 4-(2-((CYCLOHEXYLAMINO)CARBOTHIOYL)CARBOHYDRAZONOYL)PHENYL 2-CHLOROBENZOATE
pro_mdlNumber: MFCD03087507
pro_acceptors: 5
pro_donors: 2
pro_smile: c1ccc(c(c1)C(=O)Oc2ccc(cc2)/C=N/NC(=S)NC3CCCCC3)Cl
InChi: InChI=1S/C21H22ClN3O2S/c22-19-9-5-4-8-18(19)20(26)27-17-12-10-15(11-13-17)14-23-25-21(28)24-16-6-2-1-3-7-16/h4-5,8-14,16H,1-3,6-7H2,(H2,24,25,28)/b23-14+
InChiKey: InChIKey=JUNBPXQMGSMUGJ-OEAKJJBVSA-N

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