Vitas-M small molecule compound

3-chloro-N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-1-benzothiophene-2-carboxamide

Catalog ID
STK959404
SMILES Cn1ncc(c1C)CNC(=O)c1sc2c(c1Cl)cccc2

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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 C15H14ClN3OS MW 319.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14ClN3OS/c1-9-10(8-18-19(9)2)7-17-15(20)14-13(16)11-5-3-4-6-12(11)21-14/h3-6,8H,7H2,1-2H3,(H,17,20)
InChIKey
CNTZZEBIWKNZMQ-UHFFFAOYSA-N
Synonyms
489452-01-9
3chloroN((15dimethyl1Hpyrazol4yl)methyl)1benzothiophene2carboxamide
3CHLORON((15DIMETHYLPYRAZOL4YL)METHYL)1BENZOTHIOPHENE2CARBOXAMIDE
489452019
CC1=C(C=NN1C)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl
InChI=1SC15H14ClN3OSc1910(81819(9)2)71715(20)1413(16)11534612(11)2114h368H7H212H3(H1720)
MFCD02056267
ZINC000002756569
ZINC02756569
ZINC2756569

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Available files

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