Vitas-M small molecule compound
6-methyl-4-[4-(2-methylpropoxy)phenyl]-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL430269
SMILES CC(COc1ccc(cc1)C1NC(=S)NC(=C1C(=O)N)C)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 C16H21N3O2S MW 319.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O2S/c1-9(2)8-21-12-6-4-11(5-7-12)14-13(15(17)20)10(3)18-16(22)19-14/h4-7,9,14H,8H2,1-3H3,(H2,17,20)(H2,18,19,22)InChIKey
LGXKFFHMJAHOJS-UHFFFAOYSA-NSynonyms
6METHYL4(4(2METHYLPROPOXY)PHENYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
6methyl4(4(2methylpropoxy)phenyl)2thioxo1234tetrahydropyrimidine5carboxamide
CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OCC(C)C)C(=O)N
InChI=1SC16H21N3O2Sc19(2)821126411(5712)1413(15(17)20)10(3)1816(22)1914h47914H8H213H3(H21720)(H2181922)
MFCD02223983
ZINC000004574726
ZINC000004574727
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