Vitas-M small molecule compound
N-(4-cyanophenyl)-2-[(4-methyl-5-{[(4-methylphenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365802
SMILES N#Cc1ccc(cc1)NC(=O)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 C21H22N6O3S2 MW 470.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O3S2/c1-15-4-10-18(11-5-15)27(32(3,29)30)13-19-24-25-21(26(19)2)31-14-20(28)23-17-8-6-16(12-22)7-9-17/h4-11H,13-14H2,1-3H3,(H,23,28)InChIKey
SQBQMJNFVDDDBH-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N(CC2=NN=C(N2C)SCC(=O)NC3=CC=C(C=C3)C#N)S(=O)(=O)C
InChI=1SC21H22N6O3S2c11541018(11515)27(32(329)30)1319242521(26(19)2)311420(28)23178616(1222)7917h411H1314H213H3(H2328)
MFCD14833791
N(4cyanophenyl)2((4methyl5(((4methylphenyl)(methylsulfonyl)amino)methyl)4H124triazol3yl)sulfanyl)acetamide
N(4cyanophenyl)2((4methyl5((4methylNmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000019925909
ZINC19925909
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