Vitas-M small molecule compound
6-(3-bromo-5-methoxy-4-propoxyphenyl)-N-(4-methylphenyl)-4-phenyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide
Catalog ID
STK125300
SMILES CCCOc1c(Br)cc(cc1OC)C1NC(=NC(=C1C(=O)Nc1ccc(cc1)C)c1ccccc1)S
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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 C28H28BrN3O3S MW 566.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28BrN3O3S/c1-4-14-35-26-21(29)15-19(16-22(26)34-3)25-23(27(33)30-20-12-10-17(2)11-13-20)24(31-28(36)32-25)18-8-6-5-7-9-18/h5-13,15-16,25H,4,14H2,1-3H3,(H,30,33)(H2,31,32,36)InChIKey
HFPDPYADHYHCBK-UHFFFAOYSA-NSynonyms
4(3BROMO5METHOXY4PROPOXYPHENYL)N(4METHYLPHENYL)6PHENYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
6(3BROMO5METHOXY4PROPOXYPHENYL)N(4METHYLPHENYL)4PHENYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXAMIDE
CCCOC1=C(C=C(C=C1Br)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C)OC
InChI=1SC28H28BrN3O3Sc1414352621(29)1519(1622(26)343)2523(27(33)3020121017(2)111320)24(3128(36)3225)188657918h513151625H414H213H3(H3033)(H2313236)
MFCD03785068
ZINC000002143081
ZINC000002143082
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