Vitas-M small molecule compound
4-(5-bromo-2-methoxyphenyl)-N-(2,4-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL426985
SMILES COc1ccc(c(c1)OC)NC(=O)C1=C(C)NC(=S)NC1c1cc(Br)ccc1OC
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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 C21H22BrN3O4S MW 492.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O4S/c1-11-18(20(26)24-15-7-6-13(27-2)10-17(15)29-4)19(25-21(30)23-11)14-9-12(22)5-8-16(14)28-3/h5-10,19H,1-4H3,(H,24,26)(H2,23,25,30)InChIKey
IHTXWWRWLAXUCR-UHFFFAOYSA-NSynonyms
4(5BROMO2METHOXYPHENYL)N(24DIMETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
4(5bromo2methoxyphenyl)N(24dimethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
CC1=C(C(NC(=S)N1)C2=C(C=CC(=C2)Br)OC)C(=O)NC3=C(C=C(C=C3)OC)OC
InChI=1SC21H22BrN3O4Sc11118(20(26)24157613(272)1017(15)294)19(2521(30)2311)14912(22)5816(14)283h51019H14H3(H2426)(H2232530)
MFCD06002602
ZINC000001078838
ZINC000001078841
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