Vitas-M small molecule compound
1-(3,4-dimethoxyphenyl)-2-{[5-(4-methoxybenzyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK221930
SMILES COc1ccc(cc1)Cc1nnc(n1C)SCC(=O)c1ccc(c(c1)OC)OC
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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 C21H23N3O4S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S/c1-24-20(11-14-5-8-16(26-2)9-6-14)22-23-21(24)29-13-17(25)15-7-10-18(27-3)19(12-15)28-4/h5-10,12H,11,13H2,1-4H3InChIKey
KDPCCPHZAQHCIH-UHFFFAOYSA-NSynonyms
1(34DIMETHOXYPHENYL)2((5((4METHOXYPHENYL)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIMETHOXYPHENYL)2((5(4METHOXYBENZYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ETHANONE
CN1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)OC)OC)CC3=CC=C(C=C3)OC
InChI=1SC21H23N3O4Sc12420(11145816(262)9614)222321(24)291317(25)1571018(273)19(1215)284h51012H1113H214H3
MFCD07401712
ZINC000004816302
ZINC04816302
ZINC4816302
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