Vitas-M small molecule compound

N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide

Catalog ID
STK518443
SMILES CCCCSc1nnc(s1)NC(=O)c1sc2c(c1Cl)ccc(c2)F

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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 C15H13ClFN3OS3 MW 401.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClFN3OS3/c1-2-3-6-22-15-20-19-14(24-15)18-13(21)12-11(16)9-5-4-8(17)7-10(9)23-12/h4-5,7H,2-3,6H2,1H3,(H,18,19,21)
InChIKey
OXPLXPZCRPRRMO-UHFFFAOYSA-N
Synonyms

CCCCSC1=NN=C(S1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl
InChI=1SC15H13ClFN3OS3c12362215201914(2415)1813(21)1211(16)9548(17)710(9)2312h457H236H21H3(H181921)
MFCD12918113
N(5(butylsulfanyl)134thiadiazol2yl)3chloro6fluoro1benzothiophene2carboxamide
N(5butylsulfanyl134thiadiazol2yl)3chloro6fluoro1benzothiophene2carboxamide
ZINC000027748536
ZINC27748536

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Available files

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