Vitas-M small molecule compound
3-(5-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(3-chloro-4-methylphenyl)propanamide
Catalog ID
STK267216
SMILES O=C(Nc1ccc(c(c1)Cl)C)CCc1nnc(n1C)SCC(=O)NC(C)(C)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 C19H26ClN5O2S MW 423.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26ClN5O2S/c1-12-6-7-13(10-14(12)20)21-16(26)9-8-15-23-24-18(25(15)5)28-11-17(27)22-19(2,3)4/h6-7,10H,8-9,11H2,1-5H3,(H,21,26)(H,22,27)InChIKey
QUIBAMBXPAZJCX-UHFFFAOYSA-NSynonyms
3(5((2(TERTBUTYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)N(3CHLORO4METHYLPHENYL)PROPANAMIDE
3(5(2(tertbutylamino)2oxoethyl)sulfanyl4methyl124triazol3yl)N(3chloro4methylphenyl)propanamide
3(5(TERTBUTYLCARBAMOYLMETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)N(3CHLORO4METHYLPHENYL)PROPIONAMIDE
CC1=C(C=C(C=C1)NC(=O)CCC2=NN=C(N2C)SCC(=O)NC(C)(C)C)Cl
InChI=1SC19H26ClN5O2Sc1126713(1014(12)20)2116(26)9815232418(25(15)5)281117(27)2219(23)4h6710H8911H215H3(H2126)(H2227)
MFCD09267859
ZINC000009583015
ZINC09583015
ZINC9583015
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