Vitas-M small molecule compound

ethyl [(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate

Catalog ID
STK722365
SMILES CCOC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCC(C3)C(C)(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 C18H24N2O3S2 MW 380.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O3S2/c1-5-23-13(21)9-24-17-19-15(22)14-11-7-6-10(18(2,3)4)8-12(11)25-16(14)20-17/h10H,5-9H2,1-4H3,(H,19,20,22)
InChIKey
MLQOXYSKVMLIMI-UHFFFAOYSA-N
Synonyms
351338-63-1
351338631
CCOC(=O)CSC1=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N1
CCOC(=O)CSc1nc2sc3c(c2c(=O)(nH)1)CCC(C3)C(C)(C)C
ethyl((7tertbutyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetate
ethyl2((7(tertbutyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetate
ethyl2((7tertbutyl4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetate
InChI=1SC18H24N2O3S2c152313(21)924171915(22)14117610(18(23)4)812(11)2516(14)2017h10H59H214H3(H192022)
MFCD01897884
ZINC000005093218
ZINC000005093219

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Available files

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