Vitas-M small molecule compound
3-({[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-2H-chromen-2-one
Catalog ID
STK361463
SMILES Nc1ccc(cc1)c1nnc(n1C)SCC(=O)c1cc2ccccc2oc1=O
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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 C20H16N4O3S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O3S/c1-24-18(12-6-8-14(21)9-7-12)22-23-20(24)28-11-16(25)15-10-13-4-2-3-5-17(13)27-19(15)26/h2-10H,11,21H2,1H3InChIKey
HISIASUPLPVTDM-UHFFFAOYSA-NSynonyms
3(((5(4aminophenyl)4methyl4H124triazol3yl)sulfanyl)acetyl)2Hchromen2one
3(2((5(4aminophenyl)4methyl124triazol3yl)sulfanyl)acetyl)chromen2one
CN1C(=NN=C1SCC(=O)C2=CC3=CC=CC=C3OC2=O)C4=CC=C(C=C4)N
InChI=1SC20H16N4O3Sc12418(126814(21)9712)222320(24)281116(25)151013423517(13)2719(15)26h210H1121H21H3
MFCD11696025
ZINC000009145590
ZINC09145590
ZINC9145590
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