Vitas-M small molecule compound
N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Catalog ID
STK138531
SMILES Clc1ccc(cc1)OCc1nnc(s1)NC(=O)Cn1cnc2c1c(=O)n(C)c(=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 C18H16ClN7O4S MW 461.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN7O4S/c1-24-15-14(16(28)25(2)18(24)29)26(9-20-15)7-12(27)21-17-23-22-13(31-17)8-30-11-5-3-10(19)4-6-11/h3-6,9H,7-8H2,1-2H3,(H,21,23,27)InChIKey
APJXEASAJOSDCH-UHFFFAOYSA-NSynonyms
600147-27-12(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))N(5((4CHLOROPHENOXY)METHYL)(134THIADIAZOL2YL))ACETAMIDE
600147271
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=NN=C(S3)COC4=CC=C(C=C4)Cl
InChI=1SC18H16ClN7O4Sc1241514(16(28)25(2)18(24)29)26(92015)712(27)2117232213(3117)830115310(19)4611h369H78H212H3(H212327)
MFCD03930053
N(5((4chlorophenoxy)methyl)134thiadiazol2yl)2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetamide
N(5((4CHLOROPHENOXY)METHYL)134THIADIAZOL2YL)2(13DIMETHYL26DIOXOPURIN7YL)ACETAMIDE
ZINC000009556530
ZINC09556530
ZINC9556530
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