Vitas-M small molecule compound
2-(4-butoxy-3-chlorophenyl)-2-oxoethyl carbamimidothioate
Catalog ID
STK699607
SMILES CCCCOc1ccc(cc1Cl)C(=O)CSC(=N)N
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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 C13H17ClN2O2S MW 300.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17ClN2O2S/c1-2-3-6-18-12-5-4-9(7-10(12)14)11(17)8-19-13(15)16/h4-5,7H,2-3,6,8H2,1H3,(H3,15,16)InChIKey
YIYSGJFMEXVVEV-UHFFFAOYSA-NSynonyms
(2(4BUTOXY3CHLOROPHENYL)2OXOETHYL)CARBAMIMIDOTHIOATE
2(4butoxy3chlorophenyl)2oxoethylcarbamimidothioate
2(4butoxy3chlorophenyl)2oxoethylcarbamimidothioatehydrochloride
CCCCOC1=C(C=C(C=C1)C(=O)CSC(=N)N)Cl
CCCCOc1ccc(cc1Cl)C(=O)CSC(=N)NCl
InChI=1SC13H17ClN2O2Sc12361812549(710(12)14)11(17)81913(15)16h457H2368H21H3(H31516)
MFCD00433613
ZINC000004372504
ZINC4372504
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