Vitas-M small molecule compound
3-butoxy-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Catalog ID
STK412972
SMILES CCCCOc1cccc(c1)C(=O)Nc1cc(ccc1C)c1sc2n(n1)c(nn2)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 C22H23N5O2S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2S/c1-4-5-11-29-18-8-6-7-16(12-18)20(28)23-19-13-17(10-9-14(19)2)21-26-27-15(3)24-25-22(27)30-21/h6-10,12-13H,4-5,11H2,1-3H3,(H,23,28)InChIKey
FISIPUSCNXDHSI-UHFFFAOYSA-NSynonyms
3butoxyN(2methyl5(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)benzamide
CCCCOC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)C3=NN4C(=NN=C4S3)C)C
InChI=1SC22H23N5O2Sc14511291886716(1218)20(28)23191317(10914(19)2)21262715(3)242522(27)3021h6101213H4511H213H3(H2328)
MFCD04403516
ZINC000006323506
ZINC06323506
ZINC6323506
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