Vitas-M small molecule compound
3-methyl-8-[(pentyloxy)methyl]-3-[2-(prop-2-en-1-ylamino)-1,3-thiazol-4-yl]-2,7-dioxaspiro[4.4]nonane-1,6-dione
Catalog ID
STL440850
SMILES CCCCCOCC1OC(=O)C2(C1)CC(OC2=O)(C)c1csc(n1)NCC=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 C20H28N2O5S MW 408.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O5S/c1-4-6-7-9-25-11-14-10-20(16(23)26-14)13-19(3,27-17(20)24)15-12-28-18(22-15)21-8-5-2/h5,12,14H,2,4,6-11,13H2,1,3H3,(H,21,22)InChIKey
DBUYRAXJGMLGTE-UHFFFAOYSA-NSynonyms
3(2(ALLYLAMINO)13THIAZOL4YL)3METHYL8((PENTYLOXY)METHYL)27DIOXASPIRO(44)NONANE16DIONE
3methyl8((pentyloxy)methyl)3(2(prop2en1ylamino)13thiazol4yl)27dioxaspiro(44)nonane16dione
3methyl8(pentoxymethyl)3(2(prop2enylamino)13thiazol4yl)27dioxaspiro(44)nonane16dione
7METHYL2(PENTOXYMETHYL)7(2(PROP2ENYLAMINO)13THIAZOL4YL)38DIOXASPIRO(44)NONANE49DIONE
CCCCCOCC1CC2(CC(OC2=O)(C)C3=CSC(=N3)NCC=C)C(=O)O1
InChI=1SC20H28N2O5Sc146792511141020(16(23)2614)1319(32717(20)24)15122818(2215)21852h51214H2461113H213H3(H2122)
MFCD03827855
ZINC000004112351
ZINC000004112357
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