Vitas-M small molecule compound
4-chloro-N-{1-[4-ethyl-5-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK120783
SMILES COc1cccc(c1)NC(=O)CSc1nnc(n1CC)C(NC(=O)c1ccc(cc1)Cl)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 C22H24ClN5O3S MW 473.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O3S/c1-4-28-20(14(2)24-21(30)15-8-10-16(23)11-9-15)26-27-22(28)32-13-19(29)25-17-6-5-7-18(12-17)31-3/h5-12,14H,4,13H2,1-3H3,(H,24,30)(H,25,29)InChIKey
GNXGNJKTNBOVGQ-UHFFFAOYSA-NSynonyms
4CHLORON(1(4ETHYL5((2((3METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)ETHYL)BENZAMIDE
4CHLORON(1(4ETHYL5(2(3METHOXYANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)OC)C(C)NC(=O)C3=CC=C(C=C3)Cl
InChI=1SC22H24ClN5O3Sc142820(14(2)2421(30)1581016(23)11915)262722(28)321319(29)251765718(1217)313h51214H413H213H3(H2430)(H2529)
MFCD04211979
ZINC000001130379
ZINC000001130382
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