Vitas-M small molecule compound
methyl 3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzoate
Catalog ID
STK026663
SMILES COC(=O)c1cccc(c1)CSc1nnc(s1)C
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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 C12H12N2O2S2 MW 280.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O2S2/c1-8-13-14-12(18-8)17-7-9-4-3-5-10(6-9)11(15)16-2/h3-6H,7H2,1-2H3InChIKey
KJLODWNPVZRZCZ-UHFFFAOYSA-NSynonyms
462077-65-2462077652
CC1=NN=C(S1)SCC2=CC=CC(=C2)C(=O)OC
COC(=O)c1cccc(c1)CSc1nnc(s1)C
InChI=1SC12H12N2O2S2c18131412(188)177943510(69)11(15)162h36H7H212H3
METHYL3(((5METHYL134THIADIAZOL2YL)SULFANYL)METHYL)BENZOATE
methyl3(((5methyl134thiadiazol2yl)thio)methyl)benzoate
METHYL3((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)BENZOATE
MFCD01141226
STK026663
ZINC000000552121
ZINC00552121
ZINC552121
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