Vitas-M small molecule compound
methyl 4-[({[5-(3,5-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK328719
SMILES COc1cc(OC)cc(c1)c1nnc(s1)SCC(=O)Nc1ccc(cc1)C(=O)OC
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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 C20H19N3O5S2 MW 445.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O5S2/c1-26-15-8-13(9-16(10-15)27-2)18-22-23-20(30-18)29-11-17(24)21-14-6-4-12(5-7-14)19(25)28-3/h4-10H,11H2,1-3H3,(H,21,24)InChIKey
JXNULJJCDCKIIF-UHFFFAOYSA-NSynonyms
878443-46-0878443460
COC1=CC(=CC(=C1)C2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)C(=O)OC)OC
InChI=1SC20H19N3O5S2c12615813(916(1015)272)18222320(3018)291117(24)21146412(5714)19(25)283h410H11H213H3(H2124)
methyl4((((5(35dimethoxyphenyl)134thiadiazol2yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((5(35DIMETHOXYPHENYL)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD06617324
ZINC000013519076
ZINC13519076
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