Vitas-M small molecule compound

pentyl [(3-methyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate

Catalog ID
STK028413
SMILES CCCn1c(SCC(=O)OCCCCC)nc2c1c(=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 C16H24N4O4S MW 368.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24N4O4S/c1-4-6-7-9-24-11(21)10-25-16-17-13-12(20(16)8-5-2)14(22)18-15(23)19(13)3/h4-10H2,1-3H3,(H,18,22,23)
InChIKey
WTQAATMTBZQUKU-UHFFFAOYSA-N
Synonyms
331751-74-7
331751747
CCCCCOC(=O)CSC1=NC2=C(N1CCC)C(=O)NC(=O)N2C
CCCn1c(SCC(=O)OCCCCC)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC16H24N4O4Sc146792411(21)102516171312(20(16)852)14(22)1815(23)19(13)3h410H213H3(H182223)
MFCD01032058
pentyl((3methyl26dioxo7propyl2367tetrahydro1Hpurin8yl)sulfanyl)acetate
pentyl2((3methyl26dioxo7propyl2367tetrahydro1Hpurin8yl)thio)acetate
PENTYL2(3METHYL26DIOXO7PROPYL137TRIHYDROPURIN8YLTHIO)ACETATE
PENTYL2(3METHYL26DIOXO7PROPYLPURIN8YL)SULFANYLACETATE
STK028413
ZINC000002057278
ZINC02057278
ZINC2057278

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Available files

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