Vitas-M small molecule compound
2-{[5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethanone
Catalog ID
STL182278
SMILES C=CCn1c(SCC(=O)N2CCOCC2)nnc1c1ccc(cc1)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 C18H22N4O2S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2S/c1-3-8-22-17(15-6-4-14(2)5-7-15)19-20-18(22)25-13-16(23)21-9-11-24-12-10-21/h3-7H,1,8-13H2,2H3InChIKey
WWVXNGXSMPMVCJ-UHFFFAOYSA-NSynonyms
2((5(4methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)1(morpholin4yl)ethanone
2((5(4methylphenyl)4prop2enyl124triazol3yl)sulfanyl)1morpholin4ylethanone
CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)N3CCOCC3
InChI=1SC18H22N4O2Sc1382217(156414(2)5715)192018(22)251316(23)2191124121021h37H1813H22H3
MFCD22125340
ZINC000020167522
ZINC20167522
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