Vitas-M small molecule compound
2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N,N-dipropylacetamide
Catalog ID
STK538813
SMILES CCCN(C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCCC3)CCC
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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 C25H31N3O3S2 MW 485.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O3S2/c1-4-14-27(15-5-2)21(29)16-32-25-26-23-22(19-8-6-7-9-20(19)33-23)24(30)28(25)17-10-12-18(31-3)13-11-17/h10-13H,4-9,14-16H2,1-3H3InChIKey
NPXXUUBLBQGNOY-UHFFFAOYSA-NSynonyms
384794-10-92((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)NNdipropylacetamide
2((3(4methoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)NNdipropylacetamide
2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)NNdipropylacetamide
384794109
CCCN(CCC)C(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)OC
InChI=1SC25H31N3O3S2c141427(1552)21(29)163225262322(19867920(19)3323)24(30)28(25)17101218(313)131117h1013H491416H213H3
MFCD03284071
ZINC000008817582
ZINC08817582
ZINC8817582
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