Vitas-M small molecule compound

methyl (7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetate

Catalog ID
STK547320
SMILES COC(=O)Cn1cnc2c(c1=O)c1CCC(Cc1s2)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 C14H16N2O3S MW 292.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O3S/c1-8-3-4-9-10(5-8)20-13-12(9)14(18)16(7-15-13)6-11(17)19-2/h7-8H,3-6H2,1-2H3
InChIKey
RFEMZMXHESJOKH-UHFFFAOYSA-N
Synonyms
459416-26-3
459416263
CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)CC(=O)OC
InChI=1SC14H16N2O3Sc1834910(58)201312(9)14(18)16(71513)611(17)192h78H36H212H3
methyl(7methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)acetate
methyl2(7methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)acetate
methyl2(7methyl4oxo5678tetrahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)acetate
MFCD02958340
ZINC000000339635
ZINC000000339636

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.