Vitas-M small molecule compound
ethyl (2Z)-4-methyl-2-({[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}imino)-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STK565669
SMILES CCOC(=O)c1s/c(=N\C(=O)CSc2nc3sc4c(c3c(=O)n2c2ccccc2)CCCC4)/[nH]c1C
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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 C25H24N4O4S3 MW 540.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4S3/c1-3-33-23(32)20-14(2)26-24(36-20)27-18(30)13-34-25-28-21-19(16-11-7-8-12-17(16)35-21)22(31)29(25)15-9-5-4-6-10-15/h4-6,9-10H,3,7-8,11-13H2,1-2H3,(H,26,27,30)InChIKey
DCURDQKGHVWUQE-UHFFFAOYSA-NSynonyms
494826-08-3494826083
CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5)C
CCOC(=O)c1sc(=NC(=O)CSc2nc3sc4c(c3c(=O)n2c2ccccc2)CCCC4)(nH)c1C
ethyl(2Z)4methyl2((((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetyl)imino)23dihydro13thiazole5carboxylate
ethyl4methyl2((2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetyl)amino)13thiazole5carboxylate
InChI=1SC25H24N4O4S3c133323(32)2014(2)2624(3620)2718(30)133425282119(1611781217(16)3521)22(31)29(25)1595461015h46910H3781113H212H3(H262730)
MFCD03808752
ZINC000002359366
ZINC02359366
ZINC2359366
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