Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-3-(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)propanamide
Catalog ID
STK218595
SMILES O=C(Nc1ccc(c(c1)Cl)C)CCc1nnc(n1C)SCC(=O)NC1CCCCC1
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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 C21H28ClN5O2S MW 450.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28ClN5O2S/c1-14-8-9-16(12-17(14)22)24-19(28)11-10-18-25-26-21(27(18)2)30-13-20(29)23-15-6-4-3-5-7-15/h8-9,12,15H,3-7,10-11,13H2,1-2H3,(H,23,29)(H,24,28)InChIKey
LRHSLTUQMRCKIO-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CCC2=NN=C(N2C)SCC(=O)NC3CCCCC3)Cl
InChI=1SC21H28ClN5O2Sc1148916(1217(14)22)2419(28)111018252621(27(18)2)301320(29)23156435715h891215H37101113H212H3(H2329)(H2428)
MFCD07399182
N(3CHLORO4METHYLPHENYL)3(5((2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PROPANAMIDE
N(3CHLORO4METHYLPHENYL)3(5(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)PROPANAMIDE
ZINC000009262973
ZINC09262973
ZINC9262973
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