Vitas-M small molecule compound

3-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine

Catalog ID
STK544098
SMILES CSc1nc2sc3c(c2c2n1c(SCc1ccc4c(c1)OCO4)nn2)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 C21H20N4O3S3 MW 472.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S3/c1-21(2)7-12-15(8-28-21)31-18-16(12)17-23-24-20(25(17)19(22-18)29-3)30-9-11-4-5-13-14(6-11)27-10-26-13/h4-6H,7-10H2,1-3H3
InChIKey
VODMQPBAPSNEHV-UHFFFAOYSA-N
Synonyms
497942-74-2
3((13benzodioxol5ylmethyl)sulfanyl)1010dimethyl5(methylsulfanyl)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
3((benzo(d)(13)dioxol5ylmethyl)thio)1010dimethyl5(methylthio)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
497942742
CC1(CC2=C(CO1)SC3=C2C4=NN=C(N4C(=N3)SC)SCC5=CC6=C(C=C5)OCO6)C
InChI=1SC21H20N4O3S3c121(2)71215(82821)311816(12)17232420(25(17)19(2218)293)30911451314(611)27102613h46H710H213H3
MFCD03301426
ZINC000001251738
ZINC01251738
ZINC1251738

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Available files

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