Vitas-M small molecule compound
methyl 4-{3-methoxy-4-[2-oxo-2-(piperidin-1-yl)ethoxy]phenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK754393
SMILES COC(=O)C1=C(C)NC(=S)NC1c1ccc(c(c1)OC)OCC(=O)N1CCCCC1
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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 C21H27N3O5S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O5S/c1-13-18(20(26)28-3)19(23-21(30)22-13)14-7-8-15(16(11-14)27-2)29-12-17(25)24-9-5-4-6-10-24/h7-8,11,19H,4-6,9-10,12H2,1-3H3,(H2,22,23,30)InChIKey
VLZUIMSIAHRGHQ-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)OCC(=O)N3CCCCC3)OC)C(=O)OC
InChI=1SC21H27N3O5Sc11318(20(26)283)19(2321(30)2213)147815(16(1114)272)291217(25)2495461024h781119H4691012H213H3(H2222330)
methyl4(3methoxy4(2oxo2(piperidin1yl)ethoxy)phenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
METHYL4(3METHOXY4(2OXO2PIPERIDIN1YLETHOXY)PHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
MFCD00825659
ZINC000001031496
ZINC000001031499
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