Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-3-(3-methylphenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL125591
SMILES Cc1cccc(c1)n1c(=O)n(Cc2ccc3c(c2)OCO3)c2c(c1=O)scc2
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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 C21H16N2O4S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O4S/c1-13-3-2-4-15(9-13)23-20(24)19-16(7-8-28-19)22(21(23)25)11-14-5-6-17-18(10-14)27-12-26-17/h2-10H,11-12H2,1H3InChIKey
YWCAXWLAHZSVNR-UHFFFAOYSA-NSynonyms
1(13benzodioxol5ylmethyl)3(3methylphenyl)thieno(32d)pyrimidine24(1H3H)dione
1(13benzodioxol5ylmethyl)3(3methylphenyl)thieno(32d)pyrimidine24dione
CC1=CC(=CC=C1)N2C(=O)C3=C(C=CS3)N(C2=O)CC4=CC5=C(C=C4)OCO5
InChI=1SC21H16N2O4Sc11332415(913)2320(24)1916(782819)22(21(23)25)1114561718(1014)27122617h210H1112H21H3
MFCD20737420
ZINC000067258129
ZINC67258129
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