Vitas-M small molecule compound
[(7,7-dimethyl-5-oxo-4-phenyl-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetonitrile
Catalog ID
STK099722
SMILES N#CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(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 C20H17N5O2S2 MW 423.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5O2S2/c1-20(2)10-13-14(11-27-20)29-17-15(13)16(26)24(12-6-4-3-5-7-12)18-22-23-19(25(17)18)28-9-8-21/h3-7H,9-11H2,1-2H3InChIKey
RGJWPMZJPWSXCR-UHFFFAOYSA-NSynonyms
((77dimethyl5oxo4phenyl4569tetrahydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetonitrile
CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC#N)C5=CC=CC=C5)C
InChI=1SC20H17N5O2S2c120(2)101314(112720)291715(13)16(26)24(126435712)18222319(25(17)18)289821h37H911H212H3
MFCD08671216
N#CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(C)C
STK099722
ZINC000009762256
ZINC09762256
ZINC9762256
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