Vitas-M small molecule compound
2-(4-butoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-4-thione
Catalog ID
STL037490
SMILES CCCCOc1ccc(cc1)c1nc2sc3c(c2c(=S)[nH]1)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 C21H24N2O2S2 MW 400.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O2S2/c1-4-5-10-24-14-8-6-13(7-9-14)18-22-19(26)17-15-11-21(2,3)25-12-16(15)27-20(17)23-18/h6-9H,4-5,10-12H2,1-3H3,(H,22,23,26)InChIKey
WBJSOUGBMCELGI-UHFFFAOYSA-NSynonyms
672271-39-52(4butoxyphenyl)66dimethyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidine4thione
2(4butoxyphenyl)66dimethyl58dihydro3Hpyrano(23)thieno(24b)pyrimidine4thione
672271395
CCCCOC1=CC=C(C=C1)C2=NC3=C(C4=C(S3)COC(C4)(C)C)C(=S)N2
CCCCOc1ccc(cc1)c1nc2sc3c(c2c(=S)(nH)1)CC(OC3)(C)C
InChI=1SC21H24N2O2S2c1451024148613(7914)182219(26)17151121(23)251216(15)2720(17)2318h69H451012H213H3(H222326)
MFCD03804618
ZINC000001803817
ZINC01803817
ZINC1803817
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