Vitas-M small molecule compound
methyl 4-[({[3-(3-methylbutyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL029355
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc2ccsc2c(=O)n1CCC(C)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 C21H23N3O4S2 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S2/c1-13(2)8-10-24-19(26)18-16(9-11-29-18)23-21(24)30-12-17(25)22-15-6-4-14(5-7-15)20(27)28-3/h4-7,9,11,13H,8,10,12H2,1-3H3,(H,22,25)InChIKey
DXDBSJSKMUXFBK-UHFFFAOYSA-NSynonyms
1252825-08-31252825083
CC(C)CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC21H23N3O4S2c113(2)8102419(26)1816(9112918)2321(24)301217(25)22156414(5715)20(27)283h4791113H81012H213H3(H2225)
methyl4((((3(3methylbutyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl4((2(3(3methylbutyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18189663
ZINC000057426058
ZINC57426058
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