Vitas-M small molecule compound
ethyl 6-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-4-(2,5-diethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK777424
SMILES CCOc1ccc(c(c1)C1NC(=O)NC(=C1C(=O)OCC)CSc1nc2c(o1)cccc2)OCC
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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 C25H27N3O6S MW 497.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O6S/c1-4-31-15-11-12-19(32-5-2)16(13-15)22-21(23(29)33-6-3)18(26-24(30)28-22)14-35-25-27-17-9-7-8-10-20(17)34-25/h7-13,22H,4-6,14H2,1-3H3,(H2,26,28,30)InChIKey
ZZNISPPBOVYQST-UHFFFAOYSA-NSynonyms
CCOC1=CC(=C(C=C1)OCC)C2C(=C(NC(=O)N2)CSC3=NC4=CC=CC=C4O3)C(=O)OCC
ETHYL4(BENZOXAZOL2YLTHIOMETHYL)6(25DIETHOXYPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
ethyl6((13benzoxazol2ylsulfanyl)methyl)4(25diethoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6(13BENZOXAZOL2YLSULFANYLMETHYL)4(25DIETHOXYPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC25H27N3O6Sc143115111219(3252)16(1315)2221(23(29)3363)18(2624(30)2822)14352527179781020(17)3425h71322H4614H213H3(H2262830)
MFCD05260532
ZINC000001067219
ZINC000001067221
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