Vitas-M small molecule compound
2,2'-{[12-(propan-2-yl)-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]pyrrolo[1,2-a][1,2,4]triazolo[4,3-c]pyrimidine-3,7-diyl]disulfanediyl}bis[1-(4-bromophenyl)ethanone]
Catalog ID
STK935557
SMILES Brc1ccc(cc1)C(=O)CSc1ccc2n1c1sc3c(c1c1n2c(SCC(=O)c2ccc(cc2)Br)nn1)CC(OC3)C(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C32H26Br2N4O3S3 MW 770.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26Br2N4O3S3/c1-17(2)25-13-22-26(14-41-25)44-31-29(22)30-35-36-32(43-16-24(40)19-5-9-21(34)10-6-19)38(30)27-11-12-28(37(27)31)42-15-23(39)18-3-7-20(33)8-4-18/h3-12,17,25H,13-16H2,1-2H3InChIKey
GUEQHSCKLMTQTB-UHFFFAOYSA-NSynonyms
22((12(propan2yl)1213dihydro10Hpyrano(4345)thieno(32e)pyrrolo(12a)(124)triazolo(43c)pyrimidine37diyl)disulfanediyl)bis(1(4bromophenyl)ethanone)
22((12isopropyl1213dihydro10Hpyrano(4345)thieno(32e)pyrrolo(12a)(124)triazolo(43c)pyrimidine37diyl)bis(sulfanediyl))bis(1(4bromophenyl)ethanone)
CC(C)C1CC2=C(CO1)SC3=C2C4=NN=C(N4C5=CC=C(N53)SCC(=O)C6=CC=C(C=C6)Br)SCC(=O)C7=CC=C(C=C7)Br
InChI=1SC32H26Br2N4O3S3c117(2)25132226(144125)443129(22)30353632(431624(40)195921(34)10619)38(30)27111228(37(27)31)421523(39)183720(33)8418h3121725H1316H212H3
MFCD04077994
ZINC000150406200
ZINC000150406202
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