Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-3-(4-methyl-5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)propanamide
Catalog ID
STK267151
SMILES O=C(Nc1ccc(c(c1)Cl)C)CCc1nnc(n1C)SCC(=O)c1ccc(cc1)C
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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 C22H23ClN4O2S MW 442.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN4O2S/c1-14-4-7-16(8-5-14)19(28)13-30-22-26-25-20(27(22)3)10-11-21(29)24-17-9-6-15(2)18(23)12-17/h4-9,12H,10-11,13H2,1-3H3,(H,24,29)InChIKey
NCOPTFLLFGDBAB-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C)CCC(=O)NC3=CC(=C(C=C3)C)Cl
InChI=1SC22H23ClN4O2Sc1144716(8514)19(28)133022262520(27(22)3)101121(29)24179615(2)18(23)1217h4912H101113H213H3(H2429)
MFCD09267800
N(3CHLORO4METHYLPHENYL)3(4METHYL5((2(4METHYLPHENYL)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)PROPANAMIDE
N(3chloro4methylphenyl)3(4methyl5(2(4methylphenyl)2oxoethyl)sulfanyl124triazol3yl)propanamide
N(3CHLORO4METHYLPHENYL)3(4METHYL5(2OXO2PTOLYLETHYLSULFANYL)4H(124)TRIAZOL3YL)PROPIONAMIDE
ZINC000009582802
ZINC09582802
ZINC9582802
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