Vitas-M small molecule compound
N-(2-ethyl-6-methylphenyl)-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
STL084094
SMILES CCc1cccc(c1NC(=O)Cn1c2nc(sc2c(=O)n(c1=O)C)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 C21H25N5O3S MW 427.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O3S/c1-4-14-9-7-8-13(2)16(14)22-15(27)12-26-18-17(19(28)24(3)21(26)29)30-20(23-18)25-10-5-6-11-25/h7-9H,4-6,10-12H2,1-3H3,(H,22,27)InChIKey
UALAIURGGIKTFY-UHFFFAOYSA-NSynonyms
CCC1=CC=CC(=C1NC(=O)CN2C3=C(C(=O)N(C2=O)C)SC(=N3)N4CCCC4)C
InChI=1SC21H25N5O3Sc141497813(2)16(14)2215(27)12261817(19(28)24(3)21(26)29)3020(2318)2510561125h79H461012H213H3(H2227)
MFCD18202664
N(2ethyl6methylphenyl)2(6methyl57dioxo2(pyrrolidin1yl)67dihydro(13)thiazolo(45d)pyrimidin4(5H)yl)acetamide
N(2ethyl6methylphenyl)2(6methyl57dioxo2pyrrolidin1yl(13)thiazolo(45d)pyrimidin4yl)acetamide
ZINC000057520581
ZINC57520581
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