Vitas-M small molecule compound

N-cyclopropyl-4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazine-1-carbothioamide

Catalog ID
STK262623
SMILES S=C(N1CCN(CC1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C)NC1CC1

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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 C15H21N7O2S MW 363.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N7O2S/c1-19-11-10(12(23)20(2)15(19)24)17-13(18-11)21-5-7-22(8-6-21)14(25)16-9-3-4-9/h9H,3-8H2,1-2H3,(H,16,25)(H,17,18)
InChIKey
CDXJJZVBUCSTNO-UHFFFAOYSA-N
Synonyms
885899-97-8
8(4((CYCLOPROPYLAMINO)THIOXOMETHYL)PIPERAZINYL)13DIMETHYL137TRIHYDROPURINE26DIONE
885899978
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)C(=S)NC4CC4
InChI=1SC15H21N7O2Sc1191110(12(23)20(2)15(19)24)1713(1811)215722(8621)14(25)169349h9H38H212H3(H1625)(H1718)
MFCD07037344
Ncyclopropyl4(13dimethyl26dioxo2367tetrahydro1Hpurin8yl)piperazine1carbothioamide
Ncyclopropyl4(13dimethyl26dioxo7Hpurin8yl)piperazine1carbothioamide
S=C(N1CCN(CC1)c1(nH)c2c(n1)n(C)c(=O)n(c2=O)C)NC1CC1
ZINC000004818395
ZINC04818395
ZINC4818395

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Available files

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