Vitas-M small molecule compound
2,4-dichloro-N-{1-[5-({2-[(4-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK142050
SMILES O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1C)C(NC(=O)c1ccc(cc1Cl)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 C21H20Cl3N5O2S MW 512.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20Cl3N5O2S/c1-11-8-13(22)5-7-17(11)26-18(30)10-32-21-28-27-19(29(21)3)12(2)25-20(31)15-6-4-14(23)9-16(15)24/h4-9,12H,10H2,1-3H3,(H,25,31)(H,26,30)InChIKey
VBWFUEJDWFXXJV-UHFFFAOYSA-NSynonyms
24DICHLORON(1(5((2((4CHLORO2METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
24DICHLORON(1(5(2(4CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2C)C(C)NC(=O)C3=C(C=C(C=C3)Cl)Cl
InChI=1SC21H20Cl3N5O2Sc111813(22)5717(11)2618(30)103221282719(29(21)3)12(2)2520(31)156414(23)916(15)24h4912H10H213H3(H2531)(H2630)
MFCD04214084
ZINC000001128620
ZINC000001128622
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