Vitas-M small molecule compound

ethyl 2-[({[3-(butan-2-yl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate

Catalog ID
STL131341
SMILES CCOC(=O)c1ccccc1NC(=O)CSc1nc2ccsc2c(=O)n1C(CC)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/c1-4-13(3)24-19(26)18-16(10-11-29-18)23-21(24)30-12-17(25)22-15-9-7-6-8-14(15)20(27)28-5-2/h6-11,13H,4-5,12H2,1-3H3,(H,22,25)
InChIKey
VWXBLOUSVCZRIP-UHFFFAOYSA-N
Synonyms
1326850-42-3
1326850423
CCC(C)N1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=CC=CC=C3C(=O)OCC
ethyl2((((3(butan2yl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ethyl2((2(3butan2yl4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
ETHYL2(2((3(SECBUTYL)4OXO34DIHYDROTHIENO(32D)PYRIMIDIN2YL)THIO)ACETAMIDO)BENZOATE
InChI=1SC21H23N3O4S2c1413(3)2419(26)1816(10112918)2321(24)301217(25)2215976814(15)20(27)2852h61113H4512H213H3(H2225)
MFCD20751257
ZINC000067335090
ZINC000067335094

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Available files

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