Vitas-M small molecule compound
N-(2-chloro-4-methylphenyl)-2-[3-(3-methylbutyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STL030215
SMILES CC(CCn1c(=O)n(CC(=O)Nc2ccc(cc2Cl)C)c2c(c1=O)scc2)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 C20H22ClN3O3S MW 419.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3O3S/c1-12(2)6-8-23-19(26)18-16(7-9-28-18)24(20(23)27)11-17(25)22-15-5-4-13(3)10-14(15)21/h4-5,7,9-10,12H,6,8,11H2,1-3H3,(H,22,25)InChIKey
KSGRUBSWJHRTKS-UHFFFAOYSA-NSynonyms
1252926-19-41252926194
CC1=CC(=C(C=C1)NC(=O)CN2C3=C(C(=O)N(C2=O)CCC(C)C)SC=C3)Cl
InChI=1SC20H22ClN3O3Sc112(2)682319(26)1816(792818)24(20(23)27)1117(25)22155413(3)1014(15)21h45791012H6811H213H3(H2225)
MFCD18190403
N(2chloro4methylphenyl)2(3(3methylbutyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
N(2chloro4methylphenyl)2(3(3methylbutyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057426647
ZINC57426647
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