Vitas-M small molecule compound
N-(2-nitrophenyl)-2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Catalog ID
STK997320
SMILES O=C(Nc1ccccc1[N+](=O)[O-])CSc1nc2c(n1C)c(=O)n(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 C16H16N6O5S MW 404.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O5S/c1-19-12-13(20(2)16(25)21(3)14(12)24)18-15(19)28-8-11(23)17-9-6-4-5-7-10(9)22(26)27/h4-7H,8H2,1-3H3,(H,17,23)InChIKey
AZMKCQMEKRKQGJ-UHFFFAOYSA-NSynonyms
341952-01-0341952010
CN1C2=C(N=C1SCC(=O)NC3=CC=CC=C3(N+)(=O)(O))N(C(=O)N(C2=O)C)C
InChI=1SC16H16N6O5Sc1191213(20(2)16(25)21(3)14(12)24)1815(19)28811(23)179645710(9)22(26)27h47H8H213H3(H1723)
MFCD01439849
N(2nitrophenyl)2((137trimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetamide
N(2nitrophenyl)2((137trimethyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetamide
N(2NITROPHENYL)2(137TRIMETHYL26DIOXOPURIN8YL)SULFANYLACETAMIDE
O=C(Nc1ccccc1(N+)(=O)(O))CSc1nc2c(n1C)c(=O)n(c(=O)n2C)C
ZINC000009331483
ZINC09331483
ZINC9331483
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