Vitas-M small molecule compound
2-({5-[(2-ethoxy-4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone
Catalog ID
STK218965
SMILES CCOc1cc(C)ccc1OCc1nnc(n1CC=C)SCC(=O)c1ccccc1
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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 C23H25N3O3S MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O3S/c1-4-13-26-22(15-29-20-12-11-17(3)14-21(20)28-5-2)24-25-23(26)30-16-19(27)18-9-7-6-8-10-18/h4,6-12,14H,1,5,13,15-16H2,2-3H3InChIKey
GPVKPGIJAHGRTI-UHFFFAOYSA-NSynonyms
2((5((2ETHOXY4METHYLPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5((2ETHOXY4METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2CC=C)SCC(=O)C3=CC=CC=C3
InChI=1SC23H25N3O3Sc14132622(152920121117(3)1421(20)2852)242523(26)301619(27)1897681018h461214H15131516H223H3
MFCD06000587
ZINC000002868593
ZINC02868593
ZINC2868593
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