Vitas-M small molecule compound
N-[2-({2-[(2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL333126
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1cccc(c1C)C)CSc1nncn1C
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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 C22H22N6O2S3 MW 498.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2S3/c1-13-5-4-6-16(14(13)2)25-20(30)11-32-22-26-17-8-7-15(9-18(17)33-22)24-19(29)10-31-21-27-23-12-28(21)3/h4-9,12H,10-11H2,1-3H3,(H,24,29)(H,25,30)InChIKey
LIEYBECMBMKMCI-UHFFFAOYSA-NSynonyms
487021-99-8487021998
CC1=C(C(=CC=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CSC4=NN=CN4C)C
InChI=1SC22H22N6O2S3c11354616(14(13)2)2520(30)11322226178715(918(17)3322)2419(29)10312127231228(21)3h4912H1011H213H3(H2429)(H2530)
MFCD03286408
N(2((2((23dimethylphenyl)amino)2oxoethyl)sulfanyl)13benzothiazol6yl)2((4methyl4H124triazol3yl)sulfanyl)acetamide
N(2(2(23DIMETHYLANILINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)2((4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(23dimethylphenyl)2((6(2((4methyl4H124triazol3yl)thio)acetamido)benzo(d)thiazol2yl)thio)acetamide
ZINC000002320926
ZINC02320926
ZINC2320926
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