Vitas-M small molecule compound
N-[1-(4-methoxyphenyl)ethyl]-2-[6-methyl-5,7-dioxo-2-(pyrrolidin-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
Catalog ID
STL084564
SMILES COc1ccc(cc1)C(NC(=O)Cn1c(=O)n(C)c(=O)c2c1nc(s2)N1CCCC1)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 C21H25N5O4S MW 443.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O4S/c1-13(14-6-8-15(30-3)9-7-14)22-16(27)12-26-18-17(19(28)24(2)21(26)29)31-20(23-18)25-10-4-5-11-25/h6-9,13H,4-5,10-12H2,1-3H3,(H,22,27)InChIKey
RKEUEEBPTQHYFY-UHFFFAOYSA-NSynonyms
CC(C1=CC=C(C=C1)OC)NC(=O)CN2C3=C(C(=O)N(C2=O)C)SC(=N3)N4CCCC4
InChI=1SC21H25N5O4Sc113(146815(303)9714)2216(27)12261817(19(28)24(2)21(26)29)3120(2318)2510451125h6913H451012H213H3(H2227)
MFCD18203128
N(1(4methoxyphenyl)ethyl)2(6methyl57dioxo2(pyrrolidin1yl)67dihydro(13)thiazolo(45d)pyrimidin4(5H)yl)acetamide
N(1(4methoxyphenyl)ethyl)2(6methyl57dioxo2pyrrolidin1yl(13)thiazolo(45d)pyrimidin4yl)acetamide
ZINC000057522457
ZINC000057522462
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