Vitas-M small molecule compound
N-cyclohexyl-N-methyl-2-[(4-methyl-5-{[(4-methylphenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365886
SMILES Cc1ccc(cc1)N(S(=O)(=O)C)Cc1nnc(n1C)SCC(=O)N(C1CCCCC1)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 C21H31N5O3S2 MW 465.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N5O3S2/c1-16-10-12-18(13-11-16)26(31(4,28)29)14-19-22-23-21(25(19)3)30-15-20(27)24(2)17-8-6-5-7-9-17/h10-13,17H,5-9,14-15H2,1-4H3InChIKey
WSXJOBPEECEQFD-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N(CC2=NN=C(N2C)SCC(=O)N(C)C3CCCCC3)S(=O)(=O)C
InChI=1SC21H31N5O3S2c116101218(131116)26(31(428)29)1419222321(25(19)3)301520(27)24(2)178657917h101317H591415H214H3
MFCD14833803
NcyclohexylNmethyl2((4methyl5(((4methylphenyl)(methylsulfonyl)amino)methyl)4H124triazol3yl)sulfanyl)acetamide
NcyclohexylNmethyl2((4methyl5((4methylNmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000015019676
ZINC15019676
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