Vitas-M small molecule compound

N-{4-[chloro(difluoro)methoxy]phenyl}-2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide

Catalog ID
STK766009
SMILES O=C(Nc1ccc(cc1)OC(Cl)(F)F)CSc1nnnn1c1c(C)cc(cc1C)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 C19H18ClF2N5O2S MW 453.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClF2N5O2S/c1-11-8-12(2)17(13(3)9-11)27-18(24-25-26-27)30-10-16(28)23-14-4-6-15(7-5-14)29-19(20,21)22/h4-9H,10H2,1-3H3,(H,23,28)
InChIKey
JTSQARQRQSJXOR-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C(=C1)C)N2C(=NN=N2)SCC(=O)NC3=CC=C(C=C3)OC(F)(F)Cl)C
InChI=1SC19H18ClF2N5O2Sc111812(2)17(13(3)911)2718(24252627)301016(28)23144615(7514)2919(2021)22h49H10H213H3(H2328)
MFCD02934701
N(4(chloro(difluoro)methoxy)phenyl)2((1(246trimethylphenyl)1Htetrazol5yl)sulfanyl)acetamide
N(4(CHLORO(DIFLUORO)METHOXY)PHENYL)2(1(246TRIMETHYLPHENYL)TETRAZOL5YL)SULFANYLACETAMIDE
ZINC000000718700
ZINC00718700
ZINC718700

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.