Vitas-M small molecule compound
N-benzyl-6-methyl-2-thioxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL426997
SMILES S=C1NC(=C(C(N1)c1ccccc1C(F)(F)F)C(=O)NCc1ccccc1)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 C20H18F3N3OS MW 405.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F3N3OS/c1-12-16(18(27)24-11-13-7-3-2-4-8-13)17(26-19(28)25-12)14-9-5-6-10-15(14)20(21,22)23/h2-10,17H,11H2,1H3,(H,24,27)(H2,25,26,28)InChIKey
ACQWOIVUEBBUFA-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CC=CC=C2C(F)(F)F)C(=O)NCC3=CC=CC=C3
InChI=1SC20H18F3N3OSc11216(18(27)2411137324813)17(2619(28)2512)149561015(14)20(2122)23h21017H11H21H3(H2427)(H2252628)
MFCD06006734
NBENZYL6METHYL2SULFANYLIDENE4(2(TRIFLUOROMETHYL)PHENYL)34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
Nbenzyl6methyl2thioxo4(2(trifluoromethyl)phenyl)1234tetrahydropyrimidine5carboxamide
ZINC000004828934
ZINC000004828936
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