7-ACETYL-6-[4-(ALLYLOXY)-3-BROMO-5-ETHOXYPHENYL]-3-(BUTYLSULFANYL)-6,7-DIHYDRO[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPINE

pro_cas
pro_cdbregno
CCD00296432
pro_formula
C27 H29 Br N4 O4 S
pro_molWeight
585.52

basic_info

Product_Name: 7-ACETYL-6-[4-(ALLYLOXY)-3-BROMO-5-ETHOXYPHENYL]-3-(BUTYLSULFANYL)-6,7-DIHYDRO[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPINE
EnglishSynonyms: 7-ACETYL-6-[4-(ALLYLOXY)-3-BROMO-5-ETHOXYPHENYL]-3-(BUTYLSULFANYL)-6,7-DIHYDRO[1,2,4]TRIAZINO[5,6-D][3,1]BENZOXAZEPINE
pro_mdlNumber: MFCD02182606
pro_acceptors: 8
pro_donors: 0
pro_smile: CCCCSc1nc2c(nn1)-c3ccccc3N(C(O2)c4cc(c(c(c4)Br)OCC=C)OCC)C(=O)C
InChi: InChI=1S/C27H29BrN4O4S/c1-5-8-14-37-27-29-25-23(30-31-27)19-11-9-10-12-21(19)32(17(4)33)26(36-25)18-15-20(28)24(35-13-6-2)22(16-18)34-7-3/h6,9-12,15-16,26H,2,5,7-8,13-14H2,1,3-4H3
InChiKey: InChIKey=HTSDKVRXUFGLLD-UHFFFAOYSA-N

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