Vitas-M small molecule compound
butyl ({7-[(2E)-3-chlorobut-2-en-1-yl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetate
Catalog ID
STK528386
SMILES CCCCOC(=O)CSc1nc2c(n1C/C=C(/Cl)\C)c(=O)[nH]c(=O)n2C
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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 C16H21ClN4O4S MW 400.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21ClN4O4S/c1-4-5-8-25-11(22)9-26-16-18-13-12(21(16)7-6-10(2)17)14(23)19-15(24)20(13)3/h6H,4-5,7-9H2,1-3H3,(H,19,23,24)/b10-6+InChIKey
MMCBCZWZAGWYCP-UXBLZVDNSA-NSynonyms
1164471-82-2(E)butyl2((7(3chlorobut2en1yl)3methyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetate
1164471822
2((7((E)3CHLOROBUT2ENYL)26DIKETO3METHYLPURIN8YL)THIO)ACETICACIDBUTYLESTER
2((7((E)3CHLOROBUT2ENYL)3METHYL26DIOXO8PURINYL)THIO)ACETICACIDBUTYLESTER
butyl((7((2E)3chlorobut2en1yl)3methyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
BUTYL2(7((E)3CHLORANYLBUT2ENYL)3METHYL26BIS(OXIDANYLIDENE)PURIN8YL)SULFANYLETHANOATE
BUTYL2(7((E)3CHLOROBUT2ENYL)3METHYL26DIOXOPURIN8YL)SULFANYLACETATE
CCCCOC(=O)CSC1=NC2=C(N1CC=C(C)Cl)C(=O)NC(=O)N2C
CCCCOC(=O)CSc1nc2c(n1CC=C(Cl)C)c(=O)(nH)c(=O)n2C
InChI=1SC16H21ClN4O4Sc14582511(22)92616181312(21(16)7610(2)17)14(23)1915(24)20(13)3h6H4579H213H3(H192324)b106+
MFCD01558741
ZINC000013129965
ZINC13129965
Check stock
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