Vitas-M small molecule compound
4-(7-tert-butyl-4-hydroxy-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenyl thiophene-2-carboxylate
Catalog ID
STK215804
SMILES OC1=NC(Nc2c1c1CCC(Cc1s2)C(C)(C)C)c1ccc(cc1)OC(=O)c1cccs1
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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 C25H26N2O3S2 MW 466.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O3S2/c1-25(2,3)15-8-11-17-19(13-15)32-23-20(17)22(28)26-21(27-23)14-6-9-16(10-7-14)30-24(29)18-5-4-12-31-18/h4-7,9-10,12,15,21,27H,8,11,13H2,1-3H3,(H,26,28)InChIKey
FFMNMLYKTYEOHR-UHFFFAOYSA-NSynonyms
(4(7tertbutyl4oxo235678hexahydro1H(1)benzothiolo(23d)pyrimidin2yl)phenyl)thiophene2carboxylate
4(7tertbutyl4hydroxy125678hexahydro(1)benzothieno(23d)pyrimidin2yl)phenylthiophene2carboxylate
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)OC(=O)C5=CC=CS5
InChI=1SC25H26N2O3S2c125(23)158111719(1315)322320(17)22(28)2621(2723)146916(10714)3024(29)1854123118h4791012152127H81113H213H3(H2628)
MFCD07436916
ZINC000010059372
ZINC000010059375
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