Vitas-M small molecule compound

propan-2-yl [(3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate

Catalog ID
STK528826
SMILES CC(OC(=O)CSc1nc2c(n1C)c(=O)[nH]c(=O)n2C)C

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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 C12H16N4O4S MW 312.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O4S/c1-6(2)20-7(17)5-21-12-13-9-8(15(12)3)10(18)14-11(19)16(9)4/h6H,5H2,1-4H3,(H,14,18,19)
InChIKey
NFFMDRGUDGEQJR-UHFFFAOYSA-N
Synonyms
313507-31-2
313507312
CC(C)OC(=O)CSC1=NC2=C(N1C)C(=O)NC(=O)N2C
CC(OC(=O)CSc1nc2c(n1C)c(=O)(nH)c(=O)n2C)C
InChI=1SC12H16N4O4Sc16(2)207(17)521121398(15(12)3)10(18)1411(19)16(9)4h6H5H214H3(H141819)
isopropyl2((37dimethyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetate
MFCD00230219
propan2yl((37dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
PROPAN2YL2(37DIMETHYL26DIOXOPURIN8YL)SULFANYLACETATE
ZINC000000497238
ZINC00497238
ZINC497238

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Available files

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