Vitas-M small molecule compound
ethyl 6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK777412
SMILES CCOC(=O)C1=C(CSc2nc3c(s2)cccc3)NC(=O)NC1c1ccc(cc1)OC
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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 C22H21N3O4S2 MW 455.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S2/c1-3-29-20(26)18-16(12-30-22-24-15-6-4-5-7-17(15)31-22)23-21(27)25-19(18)13-8-10-14(28-2)11-9-13/h4-11,19H,3,12H2,1-2H3,(H2,23,25,27)InChIKey
ZRFRQICUERWPRW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CSC3=NC4=CC=CC=C4S3
ethyl6((13benzothiazol2ylsulfanyl)methyl)4(4methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6(13BENZOTHIAZOL2YLSULFANYLMETHYL)4(4METHOXYPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC22H21N3O4S2c132920(26)1816(1230222415645717(15)3122)2321(27)2519(18)1381014(282)11913h41119H312H212H3(H2232527)
MFCD05260518
ZINC000001425281
ZINC000001425282
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