Vitas-M small molecule compound
2-[(2-chloro-4-fluorobenzyl)sulfanyl]-N-(4-oxo-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Catalog ID
STK445832
SMILES O=C(Nn1c(S)nc2c(c1=O)c1CCCCc1s2)CSCc1ccc(cc1Cl)F
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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 C19H17ClFN3O2S3 MW 470.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClFN3O2S3/c20-13-7-11(21)6-5-10(13)8-28-9-15(25)23-24-18(26)16-12-3-1-2-4-14(12)29-17(16)22-19(24)27/h5-7H,1-4,8-9H2,(H,22,27)(H,23,25)InChIKey
OVGSMZAVGVYRSB-UHFFFAOYSA-NSynonyms
2((2chloro4fluorobenzyl)sulfanyl)N(4oxo2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)acetamide
2((2chloro4fluorophenyl)methylsulfanyl)N(4oxo2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin3yl)acetamide
C1CCC2=C(C1)C3=C(S2)NC(=S)N(C3=O)NC(=O)CSCC4=C(C=C(C=C4)F)Cl
InChI=1SC19H17ClFN3O2S3c2013711(21)6510(13)828915(25)232418(26)1612312414(12)2917(16)2219(24)27h57H1489H2(H2227)(H2325)
MFCD04058212
ZINC000020436006
ZINC20436006
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