Vitas-M small molecule compound
4-tert-butyl-N-{[3-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK233898
SMILES S=C(NC(=O)c1ccc(cc1)C(C)(C)C)Nc1cccc(c1)c1nn2c(s1)nnc2C
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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 C22H22N6OS2 MW 450.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6OS2/c1-13-25-26-21-28(13)27-19(31-21)15-6-5-7-17(12-15)23-20(30)24-18(29)14-8-10-16(11-9-14)22(2,3)4/h5-12H,1-4H3,(H2,23,24,29,30)InChIKey
OQBQPXLTWGSOCY-UHFFFAOYSA-NSynonyms
4tertbutylN((3(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)carbamothioyl)benzamide
CC1=NN=C2N1N=C(S2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC22H22N6OS2c11325262128(13)2719(3121)1565717(1215)2320(30)2418(29)1481016(11914)22(23)4h512H14H3(H223242930)
MFCD04966656
ZINC000004124882
ZINC04124882
ZINC4124882
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