Vitas-M small molecule compound
2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL334569
SMILES CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)CSc1nc2c(o1)cccc2
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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 C20H17N5O2S2 MW 423.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5O2S2/c1-20(2)7-11-14(8-26-20)29-18-16(11)17-23-15(24-25(17)10-21-18)9-28-19-22-12-5-3-4-6-13(12)27-19/h3-6,10H,7-9H2,1-2H3InChIKey
TUPLWTGDXKEZOC-UHFFFAOYSA-NSynonyms
489398-83-62((13benzoxazol2ylsulfanyl)methyl)1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(15c)pyrimidine
2((benzo(d)oxazol2ylthio)methyl)1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(15c)pyrimidine
489398836
CC1(CC2=C(CO1)SC3=C2C4=NC(=NN4C=N3)CSC5=NC6=CC=CC=C6O5)C
InChI=1SC20H17N5O2S2c120(2)71114(82620)291816(11)172315(2425(17)102118)928192212534613(12)2719h3610H79H212H3
MFCD03295686
ZINC000009272534
ZINC09272534
ZINC9272534
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