Vitas-M small molecule compound

4-benzyl-1-(ethylsulfanyl)-7-(propan-2-yl)-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
STK540255
SMILES CCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)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 C22H24N4O2S2 MW 440.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O2S2/c1-4-29-22-24-23-21-25(11-14-8-6-5-7-9-14)19(27)18-15-10-16(13(2)3)28-12-17(15)30-20(18)26(21)22/h5-9,13,16H,4,10-12H2,1-3H3
InChIKey
XAHBXIDKGHOCPJ-UHFFFAOYSA-N
Synonyms
370576-29-7
370576297
4benzyl1(ethylsulfanyl)7(propan2yl)69dihydro7Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl1(ethylthio)7isopropyl67dihydro4Hpyrano(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(9H)one
CCSC1=NN=C2N1C3=C(C4=C(S3)COC(C4)C(C)C)C(=O)N2CC5=CC=CC=C5
InChI=1SC22H24N4O2S2c14292224232125(11148657914)19(27)18151016(13(2)3)281217(15)3020(18)26(21)22h591316H41012H213H3
MFCD03011257
ZINC000001247576
ZINC000001247577

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Available files

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