Vitas-M small molecule compound

methyl 4-({[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STK209080
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc([nH]1)C

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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 C13H14N4O3S MW 306.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O3S/c1-8-14-13(17-16-8)21-7-11(18)15-10-5-3-9(4-6-10)12(19)20-2/h3-6H,7H2,1-2H3,(H,15,18)(H,14,16,17)
InChIKey
PCHGHROUZDHAKF-UHFFFAOYSA-N
Synonyms
672915-76-3
672915763
CC1=NC(=NN1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC
COC(=O)c1ccc(cc1)NC(=O)CSc1nnc((nH)1)C
InChI=1SC13H14N4O3Sc181413(17168)21711(18)1510539(4610)12(19)202h36H7H212H3(H1518)(H141617)
METHYL4((((5METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((5METHYL1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((5methyl4H124triazol3yl)thio)acetamido)benzoate
MFCD02872756
ZINC000001264257
ZINC01264257
ZINC1264257

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Available files

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