Vitas-M small molecule compound

N-tert-butyl-2-[3-(4-chlorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide

Catalog ID
STL077759
SMILES O=C(NC(C)(C)C)Cn1c(=O)n(c2ccc(cc2)Cl)c(=O)c2c1ccs2

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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 C18H18ClN3O3S MW 391.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O3S/c1-18(2,3)20-14(23)10-21-13-8-9-26-15(13)16(24)22(17(21)25)12-6-4-11(19)5-7-12/h4-9H,10H2,1-3H3,(H,20,23)
InChIKey
IWDXTLPLSWZXSA-UHFFFAOYSA-N
Synonyms

CC(C)(C)NC(=O)CN1C2=C(C(=O)N(C1=O)C3=CC=C(C=C3)Cl)SC=C2
InChI=1SC18H18ClN3O3Sc118(23)2014(23)102113892615(13)16(24)22(17(21)25)126411(19)5712h49H10H213H3(H2023)
MFCD18198986
Ntertbutyl2(3(4chlorophenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
Ntertbutyl2(3(4chlorophenyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057491957
ZINC57491957

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.