Vitas-M small molecule compound
N-cyclopentyl-4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazine-1-carbothioamide
Catalog ID
STK262619
SMILES S=C(N1CCN(CC1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C)NC1CCCC1
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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 C17H25N7O2S MW 391.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N7O2S/c1-21-13-12(14(25)22(2)17(21)26)19-15(20-13)23-7-9-24(10-8-23)16(27)18-11-5-3-4-6-11/h11H,3-10H2,1-2H3,(H,18,27)(H,19,20)InChIKey
YUGSDQBYXGXCMT-UHFFFAOYSA-NSynonyms
8(4((CYCLOPENTYLAMINO)THIOXOMETHYL)PIPERAZINYL)13DIMETHYL137TRIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)C(=S)NC4CCCC4
InChI=1SC17H25N7O2Sc1211312(14(25)22(2)17(21)26)1915(2013)237924(10823)16(27)1811534611h11H310H212H3(H1827)(H1920)
MFCD07037334
Ncyclopentyl4(13dimethyl26dioxo2367tetrahydro1Hpurin8yl)piperazine1carbothioamide
Ncyclopentyl4(13dimethyl26dioxo7Hpurin8yl)piperazine1carbothioamide
S=C(N1CCN(CC1)c1(nH)c2c(n1)n(C)c(=O)n(c2=O)C)NC1CCCC1
ZINC000004818393
ZINC04818393
ZINC4818393
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