Vitas-M small molecule compound
2-{[4-(2-methylpropyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STL379497
SMILES CC(Cn1c(SCC(=O)c2ccccc2)nnc1c1ccccc1)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 C20H21N3OS MW 351.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3OS/c1-15(2)13-23-19(17-11-7-4-8-12-17)21-22-20(23)25-14-18(24)16-9-5-3-6-10-16/h3-12,15H,13-14H2,1-2H3InChIKey
OVFJPHKGXGDPDK-UHFFFAOYSA-NSynonyms
2((4(2METHYLPROPYL)5PHENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((4(2methylpropyl)5phenyl4H124triazol3yl)sulfanyl)1phenylethanone
CC(C)CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C3=CC=CC=C3
InChI=1SC20H21N3OSc115(2)132319(17117481217)212220(23)251418(24)1695361016h31215H1314H212H3
MFCD03996893
ZINC000001140058
ZINC01140058
ZINC1140058
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