Vitas-M small molecule compound
2-[4-(difluoromethoxy)-3-methoxyphenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL173200
SMILES COc1cc(ccc1OC(F)F)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C18H16F2N2O3S MW 378.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F2N2O3S/c1-24-12-8-9(6-7-11(12)25-18(19)20)15-21-16(23)14-10-4-2-3-5-13(10)26-17(14)22-15/h6-8,18H,2-5H2,1H3,(H,21,22,23)InChIKey
MRXWLBDGCAIPON-UHFFFAOYSA-NSynonyms
866743-01-32(4(difluoromethoxy)3methoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4(difluoromethoxy)3methoxyphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
866743013
COC1=C(C=CC(=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)OC(F)F
COc1cc(ccc1OC(F)F)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC18H16F2N2O3Sc1241289(6711(12)2518(19)20)152116(23)1410423513(10)2617(14)2215h6818H25H21H3(H212223)
MFCD06196115
ZINC000020617894
ZINC20617894
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