Vitas-M small molecule compound

3-methyl-2-[(4-nitrobenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STL035102
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1C)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 C18H17N3O3S2 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S2/c1-20-17(22)15-13-4-2-3-5-14(13)26-16(15)19-18(20)25-10-11-6-8-12(9-7-11)21(23)24/h6-9H,2-5,10H2,1H3
InChIKey
GMEBJOWRLQXSSG-UHFFFAOYSA-N
Synonyms
700833-55-2
(O)(N+)(=O)c1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1C)CCCC3
3methyl2((4nitrobenzyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3methyl2((4nitrobenzyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3methyl2((4nitrophenyl)methylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
700833552
CN1C(=O)C2=C(N=C1SCC3=CC=C(C=C3)(N+)(=O)(O))SC4=C2CCCC4
InChI=1SC18H17N3O3S2c12017(22)1513423514(13)2616(15)1918(20)2510116812(9711)21(23)24h69H2510H21H3
MFCD02679276
ZINC000001033730
ZINC01033730
ZINC1033730

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Available files

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