Vitas-M small molecule compound
ethyl 6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-oxo-4-[2-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK778434
SMILES CCOC(=O)C1=C(CSc2nc3c(s2)cccc3)NC(=O)NC1c1ccccc1C(F)(F)F
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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 C22H18F3N3O3S2 MW 493.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3N3O3S2/c1-2-31-19(29)17-15(11-32-21-27-14-9-5-6-10-16(14)33-21)26-20(30)28-18(17)12-7-3-4-8-13(12)22(23,24)25/h3-10,18H,2,11H2,1H3,(H2,26,28,30)InChIKey
KIDAGYYONVUCSS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2C(F)(F)F)CSC3=NC4=CC=CC=C4S3
ethyl6((13benzothiazol2ylsulfanyl)methyl)2oxo4(2(trifluoromethyl)phenyl)1234tetrahydropyrimidine5carboxylate
ETHYL6(13BENZOTHIAZOL2YLSULFANYLMETHYL)2OXO4(2(TRIFLUOROMETHYL)PHENYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC22H18F3N3O3S2c123119(29)1715(11322127149561016(14)3321)2620(30)2818(17)12734813(12)22(2324)25h31018H211H21H3(H2262830)
MFCD05856617
ZINC000001427420
ZINC000001427421
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