Vitas-M small molecule compound
3,7-bis[(4-methoxybenzyl)sulfanyl]-12-(propan-2-yl)-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Catalog ID
STK940655
SMILES COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c1n2c(SCc2ccc(cc2)OC)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 C30H30N6O3S3 MW 618.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N6O3S3/c1-17(2)23-13-22-24(14-39-23)42-27-25(22)26-31-33-29(40-15-18-5-9-20(37-3)10-6-18)35(26)28-32-34-30(36(27)28)41-16-19-7-11-21(38-4)12-8-19/h5-12,17,23H,13-16H2,1-4H3InChIKey
ZUHKHWRBQWQDHD-UHFFFAOYSA-NSynonyms
12isopropyl37bis((4methoxybenzyl)thio)1213dihydro10Hpyrano(4345)thieno(32e)bis((124)triazolo)(43a43c)pyrimidine
37bis((4methoxybenzyl)sulfanyl)12(propan2yl)1213dihydro10Hpyrano(4345)thieno(32e)bis(124)triazolo(43a43c)pyrimidine
CC(C)C1CC2=C(CO1)SC3=C2C4=NN=C(N4C5=NN=C(N35)SCC6=CC=C(C=C6)OC)SCC7=CC=C(C=C7)OC
InChI=1SC30H30N6O3S3c117(2)23132224(143923)422725(22)26313329(4015185920(373)10618)35(26)28323430(36(27)28)41161971121(384)12819h5121723H1316H214H3
MFCD03300566
ZINC000100158775
ZINC000100158777
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