Vitas-M small molecule compound
N-{3-[1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3-methoxybenzamide
Catalog ID
STL134148
SMILES COc1cccc(c1)C(=O)Nc1snc(n1)c1nnn(c1C)c1ccc(c(c1)C)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 C21H20N6O2S MW 420.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O2S/c1-12-8-9-16(10-13(12)2)27-14(3)18(24-26-27)19-22-21(30-25-19)23-20(28)15-6-5-7-17(11-15)29-4/h5-11H,1-4H3,(H,22,23,25,28)InChIKey
UKDSWTQDVXBLSL-UHFFFAOYSA-NSynonyms
895118-05-5895118055
CC1=C(C=C(C=C1)N2C(=C(N=N2)C3=NSC(=N3)NC(=O)C4=CC(=CC=C4)OC)C)C
InChI=1SC21H20N6O2Sc1128916(1013(12)2)2714(3)18(242627)192221(302519)2320(28)1565717(1115)294h511H14H3(H22232528)
MFCD14983432
N(3(1(34dimethylphenyl)5methyl1H123triazol4yl)124thiadiazol5yl)3methoxybenzamide
N(3(1(34dimethylphenyl)5methyltriazol4yl)124thiadiazol5yl)3methoxybenzamide
ZINC000020597815
ZINC20597815
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