Vitas-M small molecule compound
ethyl 4-[({[4-(3-chloro-4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK233126
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(c(c1)Cl)C)c1ccncc1
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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 C25H22ClN5O3S MW 508.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O3S/c1-3-34-24(33)18-5-7-19(8-6-18)28-22(32)15-35-25-30-29-23(17-10-12-27-13-11-17)31(25)20-9-4-16(2)21(26)14-20/h4-14H,3,15H2,1-2H3,(H,28,32)InChIKey
CGYYOQQMUIBVOH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC(=C(C=C3)C)Cl)C4=CC=NC=C4
ethyl4((((4(3chloro4methylphenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((4(3CHLORO4METHYLPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC25H22ClN5O3Sc133424(33)185719(8618)2822(32)153525302923(17101227131117)31(25)209416(2)21(26)1420h414H315H212H3(H2832)
MFCD06631223
ZINC000009291060
ZINC09291060
ZINC9291060
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