Vitas-M small molecule compound
4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-methylpiperazine-1-carbothioamide
Catalog ID
STL448511
SMILES CNC(=S)N1CCN(CC1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)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 C13H19N7O2S MW 337.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N7O2S/c1-14-12(23)20-6-4-19(5-7-20)11-15-8-9(16-11)17(2)13(22)18(3)10(8)21/h4-7H2,1-3H3,(H,14,23)(H,15,16)InChIKey
VVZYJHMNBZWWDB-UHFFFAOYSA-NSynonyms
4(13dimethyl26dioxo2367tetrahydro1Hpurin8yl)Nmethylpiperazine1carbothioamide
4(13dimethyl26dioxo7Hpurin8yl)Nmethylpiperazine1carbothioamide
CNC(=S)N1CCN(CC1)c1(nH)c2c(n1)n(C)c(=O)n(c2=O)C
CNC(=S)N1CCN(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C
InChI=1SC13H19N7O2Sc11412(23)206419(5720)111589(1611)17(2)13(22)18(3)10(8)21h47H213H3(H1423)(H1516)
MFCD07773989
ZINC000004818418
ZINC4818418
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