Vitas-M small molecule compound

N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-chloro-2-(ethylsulfonyl)pyrimidine-4-carboxamide

Catalog ID
STK909826
SMILES CCCCSc1nnc(s1)NC(=O)c1nc(ncc1Cl)S(=O)(=O)CC

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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 C13H16ClN5O3S3 MW 421.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClN5O3S3/c1-3-5-6-23-13-19-18-11(24-13)17-10(20)9-8(14)7-15-12(16-9)25(21,22)4-2/h7H,3-6H2,1-2H3,(H,17,18,20)
InChIKey
GMIAEZBTPYNCSM-UHFFFAOYSA-N
Synonyms

CCCCSC1=NN=C(S1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)CC
InChI=1SC13H16ClN5O3S3c13562313191811(2413)1710(20)98(14)71512(169)25(2122)42h7H36H212H3(H171820)
MFCD06649004
N(5(butylsulfanyl)134thiadiazol2yl)5chloro2(ethylsulfonyl)pyrimidine4carboxamide
N(5butylsulfanyl134thiadiazol2yl)5chloro2ethylsulfonylpyrimidine4carboxamide
ZINC000008868059
ZINC08868059
ZINC8868059

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Available files

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