Vitas-M small molecule compound
1-(3,4-dimethoxyphenyl)-2-{[5-(furan-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK230705
SMILES COc1cc(ccc1OC)C(=O)CSc1nnc(n1C(C)C)c1ccco1
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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 C19H21N3O4S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O4S/c1-12(2)22-18(16-6-5-9-26-16)20-21-19(22)27-11-14(23)13-7-8-15(24-3)17(10-13)25-4/h5-10,12H,11H2,1-4H3InChIKey
WXTQECRPIBUATN-UHFFFAOYSA-NSynonyms
1(34dimethoxyphenyl)2((5(furan2yl)4(propan2yl)4H124triazol3yl)sulfanyl)ethanone
1(34DIMETHOXYPHENYL)2((5(FURAN2YL)4PROPAN2YL124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIMETHOXYPHENYL)2(5FURAN2YL4ISOPROPYL4H(124)TRIAZOL3YLSULFANYL)ETHANONE
CC(C)N1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CO3
InChI=1SC19H21N3O4Sc112(2)2218(166592616)202119(22)271114(23)137815(243)17(1013)254h51012H11H214H3
MFCD07791494
ZINC000004736104
ZINC04736104
ZINC4736104
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