Vitas-M small molecule compound

methyl 4-{[(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino}benzoate

Catalog ID
STK092217
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1ncn[nH]1

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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 C12H12N4O3S MW 292.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O3S/c1-19-11(18)8-2-4-9(5-3-8)15-10(17)6-20-12-13-7-14-16-12/h2-5,7H,6H2,1H3,(H,15,17)(H,13,14,16)
InChIKey
KRTAEVOJJCQJPO-UHFFFAOYSA-N
Synonyms
314043-90-8
314043908
4(2(2H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)BENZOICACIDMETHYLESTER
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=NN2
COC(=O)c1ccc(cc1)NC(=O)CSc1ncn(nH)1
InChI=1SC12H12N4O3Sc11911(18)8249(538)1510(17)62012137141612h257H6H21H3(H1517)(H131416)
METHYL4(((1H124TRIAZOL5YLSULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2(1H124TRIAZOL5YLSULFANYL)ACETYL)AMINO)BENZOATE
MFCD00818944
STK092217
ZINC000000401038
ZINC00401038
ZINC401038

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Available files

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