Vitas-M small molecule compound
N-(4-chlorophenyl)-4-(4-ethoxy-3-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL426996
SMILES CCOc1ccc(cc1OC)C1NC(=S)NC(=C1C(=O)Nc1ccc(cc1)Cl)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 C21H22ClN3O3S MW 431.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O3S/c1-4-28-16-10-5-13(11-17(16)27-3)19-18(12(2)23-21(29)25-19)20(26)24-15-8-6-14(22)7-9-15/h5-11,19H,4H2,1-3H3,(H,24,26)(H2,23,25,29)InChIKey
CVAZYFAEWMVMFC-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)NC3=CC=C(C=C3)Cl)OC
InChI=1SC21H22ClN3O3Sc14281610513(1117(16)273)1918(12(2)2321(29)2519)20(26)24158614(22)7915h51119H4H213H3(H2426)(H2232529)
MFCD06136127
N(4CHLOROPHENYL)4(4ETHOXY3METHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
N(4chlorophenyl)4(4ethoxy3methoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
ZINC000016425003
ZINC000016425007
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