Vitas-M small molecule compound
2-{[3-(4-methoxyphenyl)-4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STK831105
SMILES COc1ccc(cc1)n1c(SCC(=O)N)nc2c(c1=O)c1CCCCCc1s2
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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 C20H21N3O3S2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S2/c1-26-13-9-7-12(8-10-13)23-19(25)17-14-5-3-2-4-6-15(14)28-18(17)22-20(23)27-11-16(21)24/h7-10H,2-6,11H2,1H3,(H2,21,24)InChIKey
MTGVRQWQQNHRFY-UHFFFAOYSA-NSynonyms
351007-28-82((3(4methoxyphenyl)4oxo356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin2yl)sulfanyl)acetamide
2((3(4methoxyphenyl)4oxo456789hexahydro3Hcyclohepta(45)thieno(23d)pyrimidin2yl)thio)acetamide
2((3(4methoxyphenyl)4oxo6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin2yl)sulfanyl)acetamide
351007288
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N)SC4=C3CCCCC4
InChI=1SC20H21N3O3S2c126139712(81013)2319(25)17145324615(14)2818(17)2220(23)271116(21)24h710H2611H21H3(H22124)
MFCD01878203
ZINC000000755315
ZINC00755315
ZINC755315
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