Vitas-M small molecule compound
2-(3,4-dimethoxybenzyl)-9-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK580552
SMILES COc1cc(ccc1OC)Cc1nn2c(n1)c1c(nc2)sc2c1CCC(C2)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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-12-4-6-14-17(8-12)28-21-19(14)20-23-18(24-25(20)11-22-21)10-13-5-7-15(26-2)16(9-13)27-3/h5,7,9,11-12H,4,6,8,10H2,1-3H3InChIKey
SKMKLSZGEIVNDO-UHFFFAOYSA-NSynonyms
902016-45-92(34dimethoxybenzyl)9methyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
2(34dimethoxybenzyl)9methyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidine
902016459
CC1CCC2=C(C1)SC3=C2C4=NC(=NN4C=N3)CC5=CC(=C(C=C5)OC)OC
InChI=1SC21H22N4O2Sc112461417(812)282119(14)202318(2425(20)112221)10135715(262)16(913)273h5791112H46810H213H3
MFCD06787737
ZINC000005346338
ZINC000005346339
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