Vitas-M small molecule compound
2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Catalog ID
STL054435
SMILES C=CCn1c(SCC(=O)Nc2ccccc2OC)nnc1c1cccc(c1)Cl
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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 C20H19ClN4O2S MW 414.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O2S/c1-3-11-25-19(14-7-6-8-15(21)12-14)23-24-20(25)28-13-18(26)22-16-9-4-5-10-17(16)27-2/h3-10,12H,1,11,13H2,2H3,(H,22,26)InChIKey
LLBANRZNUJIKFC-UHFFFAOYSA-NSynonyms
861635-78-12((4allyl5(3chlorophenyl)4H124triazol3yl)thio)N(2methoxyphenyl)acetamide
2((5(3chlorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(2methoxyphenyl)acetamide
2((5(3CHLOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(2METHOXYPHENYL)ACETAMIDE
2(5(3CHLOROPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(2METHOXYPHENYL)ACETAMIDE
861635781
COC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC=C)C3=CC(=CC=C3)Cl
InChI=1SC20H19ClN4O2Sc13112519(1476815(21)1214)232420(25)281318(26)22169451017(16)272h31012H11113H22H3(H2226)
MFCD05685373
ZINC000005478622
ZINC05478622
ZINC5478622
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