Vitas-M small molecule compound
2-[5-({2-[(4-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-(2-methoxyphenyl)acetamide
Catalog ID
STK218436
SMILES COc1ccccc1NC(=O)Cc1nnc(n1C)SCC(=O)Nc1ccc(cc1C)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 C21H22ClN5O3S MW 459.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5O3S/c1-13-10-14(22)8-9-15(13)23-20(29)12-31-21-26-25-18(27(21)2)11-19(28)24-16-6-4-5-7-17(16)30-3/h4-10H,11-12H2,1-3H3,(H,23,29)(H,24,28)InChIKey
INGMODHAJKFPHG-UHFFFAOYSA-NSynonyms
2(5((2((4CHLORO2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(2METHOXYPHENYL)ACETAMIDE
2(5((4CHLORO2METHYLPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)N(2METHOXYPHENYL)ACETAMIDE
2(5(2(4CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)N(2METHOXYPHENYL)ACETAMIDE
CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2C)CC(=O)NC3=CC=CC=C3OC
InChI=1SC21H22ClN5O3Sc1131014(22)8915(13)2320(29)123121262518(27(21)2)1119(28)2416645717(16)303h410H1112H213H3(H2329)(H2428)
MFCD07189257
ZINC000009261857
ZINC09261857
ZINC9261857
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