Vitas-M small molecule compound
4-[({[4-methyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STK607699
SMILES O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc(n1C)c1nccnc1
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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 C16H14N6O3S MW 370.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N6O3S/c1-22-14(12-8-17-6-7-18-12)20-21-16(22)26-9-13(23)19-11-4-2-10(3-5-11)15(24)25/h2-8H,9H2,1H3,(H,19,23)(H,24,25)InChIKey
XUCNDCXKHUYRSC-UHFFFAOYSA-NSynonyms
887672-64-24((((4methyl5(pyrazin2yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
4((2((4METHYL5PYRAZIN2YL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
4(2((4methyl5(pyrazin2yl)4H124triazol3yl)thio)acetamido)benzoicacid
887672642
CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)O)C3=NC=CN=C3
InChI=1SC16H14N6O3Sc12214(12817671812)202116(22)26913(23)19114210(3511)15(24)25h28H9H21H3(H1923)(H2425)
MFCD07400791
ZINC000004772663
ZINC4772663
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