Vitas-M small molecule compound
[(3-benzyl-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid
Catalog ID
STK045288
SMILES OC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)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 C20H20N2O4S2 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4S2/c1-20(2)8-13-14(10-26-20)28-17-16(13)18(25)22(9-12-6-4-3-5-7-12)19(21-17)27-11-15(23)24/h3-7H,8-11H2,1-2H3,(H,23,24)InChIKey
ZVSHBMLVKCEAEH-UHFFFAOYSA-NSynonyms
351341-47-4((3benzyl66dimethyl4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)aceticacid
2((3benzyl66dimethyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)aceticacid
2((3benzyl66dimethyl4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)aceticacid
351341474
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)O)CC4=CC=CC=C4)C
InChI=1SC20H20N2O4S2c120(2)81314(102620)281716(13)18(25)22(9126435712)19(2117)271115(23)24h37H811H212H3(H2324)
MFCD01449021
OC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)(C)C
STK045288
ZINC000002240069
ZINC2240069
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