Vitas-M small molecule compound
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-{5-[(3-phenylpropyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide
Catalog ID
STK277738
SMILES O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)Nc1nnc(s1)SCCCc1ccccc1
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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 C20H21N7O3S2 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N7O3S2/c1-25-16-15(17(29)26(2)20(25)30)27(12-21-16)11-14(28)22-18-23-24-19(32-18)31-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3,(H,22,23,28)InChIKey
RCAJAZJTCJIETQ-UHFFFAOYSA-NSynonyms
893230-30-32(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))N(5(3PHENYLPROPYLTHIO)(134THIADIAZOL2YL))ACETAMIDE
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N(5((3phenylpropyl)sulfanyl)134thiadiazol2yl)acetamide
2(13dimethyl26dioxopurin7yl)N(5(3phenylpropylsulfanyl)134thiadiazol2yl)acetamide
893230303
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=NN=C(S3)SCCCC4=CC=CC=C4
InChI=1SC20H21N7O3S2c1251615(17(29)26(2)20(25)30)27(122116)1114(28)2218232419(3218)311069137435813h357812H6911H212H3(H222328)
MFCD07151223
ZINC000009095427
ZINC09095427
ZINC9095427
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