Vitas-M small molecule compound

methyl 5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]thiophene-2-carboxylate

Catalog ID
STL178988
SMILES COC(=O)c1ccc(s1)CSc1nc2c(s1)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 C14H11NO2S3 MW 321.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11NO2S3/c1-17-13(16)12-7-6-9(19-12)8-18-14-15-10-4-2-3-5-11(10)20-14/h2-7H,8H2,1H3
InChIKey
BJMSGOXJVZPKOE-UHFFFAOYSA-N
Synonyms
938013-70-8
938013708
COC(=O)C1=CC=C(S1)CSC2=NC3=CC=CC=C3S2
InChI=1SC14H11NO2S3c11713(16)12769(1912)818141510423511(10)2014h27H8H21H3
methyl5((13benzothiazol2ylsulfanyl)methyl)thiophene2carboxylate
methyl5(13benzothiazol2ylsulfanylmethyl)thiophene2carboxylate
MFCD08553683
ZINC000036612094
ZINC36612094

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Available files

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