Vitas-M small molecule compound

2-{[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-N-(3,4-dimethoxyphenyl)acetamide

Catalog ID
STK094056
SMILES COc1cc(ccc1OC)NC(=O)CSc1nnnn1c1ccc2c(c1)OCO2

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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 C18H17N5O5S MW 415.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O5S/c1-25-13-5-3-11(7-15(13)26-2)19-17(24)9-29-18-20-21-22-23(18)12-4-6-14-16(8-12)28-10-27-14/h3-8H,9-10H2,1-2H3,(H,19,24)
InChIKey
UCEUDNDTMHQTKJ-UHFFFAOYSA-N
Synonyms

2((1(13BENZODIOXOL5YL)1HTETRAAZOL5YL)SULFANYL)N(34DIMETHOXYPHENYL)ACETAMIDE
2((1(13BENZODIOXOL5YL)1HTETRAZOL5YL)SULFANYL)N(34DIMETHOXYPHENYL)ACETAMIDE
2(1(13BENZODIOXOL5YL)TETRAZOL5YL)SULFANYLN(34DIMETHOXYPHENYL)ACETAMIDE
COC1=C(C=C(C=C1)NC(=O)CSC2=NN=NN2C3=CC4=C(C=C3)OCO4)OC
COc1cc(ccc1OC)NC(=O)CSc1nnnn1c1ccc2c(c1)OCO2
InChI=1SC18H17N5O5Sc125135311(715(13)262)1917(24)9291820212223(18)12461416(812)28102714h38H910H212H3(H1924)
MFCD02232958
STK094056
ZINC000000693334
ZINC00693334
ZINC693334

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Available files

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