Vitas-M small molecule compound
3-[2-(4-chlorophenyl)-2-oxoethyl]-6-ethyl-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d][1,2,3]triazin-4-one
Catalog ID
STK778335
SMILES CCC1(C)OCc2c(C1)c1c(s2)nnn(c1=O)CC(=O)c1ccc(cc1)Cl
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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 C19H18ClN3O3S MW 403.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O3S/c1-3-19(2)8-13-15(10-26-19)27-17-16(13)18(25)23(22-21-17)9-14(24)11-4-6-12(20)7-5-11/h4-7H,3,8-10H2,1-2H3InChIKey
IIEVOHINUZURJT-UHFFFAOYSA-NSynonyms
3(2(4chlorophenyl)2oxoethyl)6ethyl6methyl3568tetrahydro4Hpyrano(4345)thieno(23d)(123)triazin4one
3(2(4chlorophenyl)2oxoethyl)6ethyl6methyl58dihydropyrano(23)thieno(24b)triazin4one
CCC1(CC2=C(CO1)SC3=C2C(=O)N(N=N3)CC(=O)C4=CC=C(C=C4)Cl)C
InChI=1SC19H18ClN3O3Sc1319(2)81315(102619)271716(13)18(25)23(222117)914(24)114612(20)7511h47H3810H212H3
MFCD05856423
ZINC000001427180
ZINC000001427181
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