Vitas-M small molecule compound
hexyl 4-[4-(diethylamino)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK000835
SMILES CCCCCCOC(=O)C1=C(C)NC(=S)NC1c1ccc(cc1)N(CC)CC
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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 C22H33N3O2S MW 403.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H33N3O2S/c1-5-8-9-10-15-27-21(26)19-16(4)23-22(28)24-20(19)17-11-13-18(14-12-17)25(6-2)7-3/h11-14,20H,5-10,15H2,1-4H3,(H2,23,24,28)InChIKey
LIFBZIOBGVUSSG-UHFFFAOYSA-NSynonyms
296262-90-3296262903
CCCCCCOC(=O)C1=C(C)NC(=S)NC1c1ccc(cc1)N(CC)CC
CCCCCCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)N(CC)CC)C
HEXYL4(4(DIETHYLAMINO)PHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
hexyl4(4(diethylamino)phenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
HEXYL6(4(DIETHYLAMINO)PHENYL)4METHYL2THIOXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC22H33N3O2Sc158910152721(26)1916(4)2322(28)2420(19)17111318(141217)25(62)73h111420H51015H214H3(H2232428)
MFCD00352948
STK000835
ZINC000004042868
ZINC000004042872
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