Vitas-M small molecule compound
7,7-dimethyl-4-phenyl-1-sulfanyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK005692
SMILES O=c1c2c3CC(C)(C)OCc3sc2n2c(n1c1ccccc1)nnc2S
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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 C18H16N4O2S2 MW 384.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O2S2/c1-18(2)8-11-12(9-24-18)26-15-13(11)14(23)21(10-6-4-3-5-7-10)16-19-20-17(25)22(15)16/h3-7H,8-9H2,1-2H3,(H,20,25)InChIKey
HYNDOAABMGLQSN-UHFFFAOYSA-NSynonyms
330819-59-51mercapto77dimethyl4phenyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
330819595
77dimethyl4phenyl1sulfanyl69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NNC(=S)N34)C5=CC=CC=C5)C
InChI=1SC18H16N4O2S2c118(2)81112(92418)261513(11)14(23)21(106435710)16192017(25)22(15)16h37H89H212H3(H2025)
MFCD01049109
O=c1c2c3CC(C)(C)OCc3sc2n2c(n1c1ccccc1)nnc2S
STK005692
ZINC000002259004
ZINC2259004
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