Vitas-M small molecule compound
6-hydroxy-3-methyl-8-(3-methylpiperidin-1-yl)-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Catalog ID
STK578531
SMILES CC1CCCN(C1)c1nc2c(n1CCSc1nnc(s1)C)c(O)nc(=O)n2C
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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 C17H23N7O2S2 MW 421.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N7O2S2/c1-10-5-4-6-23(9-10)15-18-13-12(14(25)19-16(26)22(13)3)24(15)7-8-27-17-21-20-11(2)28-17/h10H,4-9H2,1-3H3,(H,19,25,26)InChIKey
NIUMYMPGYCCHOA-UHFFFAOYSA-NSynonyms
850914-21-53METHYL7(2((5METHYL134THIADIAZOL2YL)THIO)ETHYL)8(3METHYLPIPERIDIN1YL)1HPURINE26(3H7H)DIONE
3METHYL7(2(5METHYL(134THIADIAZOL2YLTHIO))ETHYL)8(3METHYLPIPERIDYL)137TRIHYDROPURINE26DIONE
3METHYL8(3METHYLPIPERIDIN1YL)7(2((5METHYL134THIADIAZOL2YL)SULFANYL)ETHYL)PURINE26DIONE
6hydroxy3methyl8(3methylpiperidin1yl)7(2((5methyl134thiadiazol2yl)sulfanyl)ethyl)37dihydro2Hpurin2one
850914215
CC1CCCN(C1)C2=NC3=C(N2CCSC4=NN=C(S4)C)C(=O)NC(=O)N3C
InChI=1SC17H23N7O2S2c11054623(910)15181312(14(25)1916(26)22(13)3)24(15)782717212011(2)2817h10H49H213H3(H192526)
MFCD07203813
ZINC000017440291
ZINC000017440292
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