Vitas-M small molecule compound
methyl 4-[({[3-(3-methylphenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL075642
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc2ccsc2c(=O)n1c1cccc(c1)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 C23H19N3O4S2 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4S2/c1-14-4-3-5-17(12-14)26-21(28)20-18(10-11-31-20)25-23(26)32-13-19(27)24-16-8-6-15(7-9-16)22(29)30-2/h3-12H,13H2,1-2H3,(H,24,27)InChIKey
ODBKXFOLYDHKJZ-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)NC4=CC=C(C=C4)C(=O)OC
InChI=1SC23H19N3O4S2c11443517(1214)2621(28)2018(10113120)2523(26)321319(27)24168615(7916)22(29)302h312H13H212H3(H2427)
methyl4((((3(3methylphenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl4((2(3(3methylphenyl)4oxothieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18196894
ZINC000057487457
ZINC57487457
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