Vitas-M small molecule compound
N-(4-chloro-3-methylphenyl)-2-[(4-methyl-5-{[(4-methylphenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365804
SMILES O=C(Nc1ccc(c(c1)C)Cl)CSc1nnc(n1C)CN(S(=O)(=O)C)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 C21H24ClN5O3S2 MW 494.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN5O3S2/c1-14-5-8-17(9-6-14)27(32(4,29)30)12-19-24-25-21(26(19)3)31-13-20(28)23-16-7-10-18(22)15(2)11-16/h5-11H,12-13H2,1-4H3,(H,23,28)InChIKey
XAEHYOJAKMBQPG-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N(CC2=NN=C(N2C)SCC(=O)NC3=CC(=C(C=C3)Cl)C)S(=O)(=O)C
InChI=1SC21H24ClN5O3S2c1145817(9614)27(32(429)30)1219242521(26(19)3)311320(28)231671018(22)15(2)1116h511H1213H214H3(H2328)
MFCD14833797
N(4chloro3methylphenyl)2((4methyl5(((4methylphenyl)(methylsulfonyl)amino)methyl)4H124triazol3yl)sulfanyl)acetamide
N(4chloro3methylphenyl)2((4methyl5((4methylNmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000019925913
ZINC19925913
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