Vitas-M small molecule compound
methyl 3-({5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}carbamoyl)-5-nitrobenzoate
Catalog ID
STK204181
SMILES COCCSc1nnc(s1)NC(=O)c1cc(cc(c1)C(=O)OC)[N+](=O)[O-]
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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 C14H14N4O6S2 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O6S2/c1-23-3-4-25-14-17-16-13(26-14)15-11(19)8-5-9(12(20)24-2)7-10(6-8)18(21)22/h5-7H,3-4H2,1-2H3,(H,15,16,19)InChIKey
PFRSRDCTNMCPJD-UHFFFAOYSA-NSynonyms
825598-33-23(((5(2METHOXYETHYLTHIO)134THIADIAZOL2YL)AMINO)OXOMETHYL)5NITROBENZOICACIDMETHYLESTER
3((5(2METHOXYETHYLTHIO)134THIADIAZOL2YL)CARBAMOYL)5NITROBENZOICACIDMETHYLESTER
825598332
COCCSC1=NN=C(S1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COCCSc1nnc(s1)NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O)
InChI=1SC14H14N4O6S2c123342514171613(2614)1511(19)859(12(20)242)710(68)18(21)22h57H34H212H3(H151619)
METHYL3(((5((2METHOXYETHYL)THIO)134THIADIAZOL2YL)AMINO)CARBONYL)5NITROBENZOATE
METHYL3((5((2METHOXYETHYL)SULFANYL)134THIADIAZOL2YL)CARBAMOYL)5NITROBENZOATE
METHYL3((5(2METHOXYETHYLSULFANYL)134THIADIAZOL2YL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(5(2METHOXYETHYLTHIO)(134THIADIAZOL2YL))CARBAMOYL)3NITROBENZOATE
MFCD06152261
ZINC000002865431
ZINC02865431
ZINC2865431
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