Vitas-M small molecule compound
methyl 4-[(7-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)methyl]benzoate
Catalog ID
STK843138
SMILES COC(=O)c1ccc(cc1)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 C20H20N2O3S MW 368.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O3S/c1-12-3-8-15-16(9-12)26-18-17(15)19(23)22(11-21-18)10-13-4-6-14(7-5-13)20(24)25-2/h4-7,11-12H,3,8-10H2,1-2H3InChIKey
DVXWGNFQJHPRQC-UHFFFAOYSA-NSynonyms
459419-46-6459419466
CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)CC4=CC=C(C=C4)C(=O)OC
InChI=1SC20H20N2O3Sc112381516(912)261817(15)19(23)22(112118)10134614(7513)20(24)252h471112H3810H212H3
methyl4((7methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)methyl)benzoate
methyl4((7methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)methyl)benzoate
methyl4((7methyl4oxo5678tetrahydrobenzo(45)thieno(23d)pyrimidin3(4H)yl)methyl)benzoate
MFCD03109992
ZINC000000791378
ZINC000000791382
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