Vitas-M small molecule compound

2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide

Catalog ID
STK012609
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)OC

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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 C25H23ClN4O3S MW 495.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O3S/c1-3-33-22-14-8-19(9-15-22)27-23(31)16-34-25-29-28-24(17-4-12-21(32-2)13-5-17)30(25)20-10-6-18(26)7-11-20/h4-15H,3,16H2,1-2H3,(H,27,31)
InChIKey
ZNQINRQGNALDLV-UHFFFAOYSA-N
Synonyms
498547-15-2
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(4ETHOXYPHENYL)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(4ETHOXYPHENYL)ACETAMIDE
2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)N(4ethoxyphenyl)acetamide
2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(4ETHOXYPHENYL)ACETAMIDE
498547152
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC
CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)OC
InChI=1SC25H23ClN4O3Sc13332214819(91522)2723(31)163425292824(1741221(322)13517)30(25)2010618(26)71120h415H316H212H3(H2731)
MFCD03223210
STK012609
ZINC000000633453
ZINC00633453
ZINC633453

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.