Vitas-M small molecule compound
N-(4-chloro-2-fluorophenyl)-2-[(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL122298
SMILES Clc1ccc(c(c1)F)NC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)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 C18H15ClFN3O2S2 MW 423.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClFN3O2S2/c19-9-5-6-12(11(20)7-9)21-14(24)8-26-18-22-16(25)15-10-3-1-2-4-13(10)27-17(15)23-18/h5-7H,1-4,8H2,(H,21,24)(H,22,23,25)InChIKey
OVKFYOMSBFTJRU-UHFFFAOYSA-NSynonyms
C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)SCC(=O)NC4=C(C=C(C=C4)Cl)F
Clc1ccc(c(c1)F)NC(=O)CSc1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC18H15ClFN3O2S2c1995612(11(20)79)2114(24)826182216(25)1510312413(10)2717(15)2318h57H148H2(H2124)(H222325)
MFCD05342161
N(4chloro2fluorophenyl)2((4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4chloro2fluorophenyl)2((4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000008640534
ZINC08640534
ZINC8640534
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