Vitas-M small molecule compound

2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxydibenzo[b,d]furan-3-yl)acetamide

Catalog ID
STK554103
SMILES COc1cc2c(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1)oc1c2cccc1

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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 C28H20ClN5O3S MW 542.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN5O3S/c1-36-25-14-21-20-4-2-3-5-23(20)37-24(21)15-22(25)31-26(35)16-38-28-33-32-27(17-10-12-30-13-11-17)34(28)19-8-6-18(29)7-9-19/h2-15H,16H2,1H3,(H,31,35)
InChIKey
QAACUTIREQSFNO-UHFFFAOYSA-N
Synonyms
476483-69-9
2((4(4chlorophenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)N(2methoxydibenzo(bd)furan3yl)acetamide
2((4(4CHLOROPHENYL)5(PYRIDIN4YL)4H124TRIAZOL3YL)THIO)N(2METHOXYDIBENZO(BD)FURAN3YL)ACETAMIDE
2((4(4CHLOROPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(2METHOXYDIBENZOFURAN3YL)ACETAMIDE
2(4(4CHLOROPHENYL)5(4PYRIDYL)(124TRIAZOL3YLTHIO))N(2METHOXYBENZO(34B)BENZO(D)FURAN3YL)ACETAMIDE
476483699
COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=O)CSC4=NN=C(N4C5=CC=C(C=C5)Cl)C6=CC=NC=C6
InChI=1SC28H20ClN5O3Sc13625142120423523(20)3724(21)1522(25)3126(35)163828333227(17101230131117)34(28)198618(29)7919h215H16H21H3(H3135)
MFCD03222818
ZINC000059595532
ZINC59595532

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Available files

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