Vitas-M small molecule compound

1-(2,4-dimethylphenyl)-2,5-dioxopyrrolidin-3-yl N-{4-[chloro(difluoro)methoxy]phenyl}-N'-(2-phenylethyl)carbamimidothioate

Catalog ID
STK676557
SMILES Cc1ccc(c(c1)C)N1C(=O)CC(C1=O)S/C(=N/CCc1ccccc1)/Nc1ccc(cc1)OC(Cl)(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 C28H26ClF2N3O3S MW 558.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClF2N3O3S/c1-18-8-13-23(19(2)16-18)34-25(35)17-24(26(34)36)38-27(32-15-14-20-6-4-3-5-7-20)33-21-9-11-22(12-10-21)37-28(29,30)31/h3-13,16,24H,14-15,17H2,1-2H3,(H,32,33)
InChIKey
VSYDXTCZUVFPLJ-UHFFFAOYSA-N
Synonyms

(1(24dimethylphenyl)25dioxopyrrolidin3yl)N(4(chloro(difluoro)methoxy)phenyl)N(2phenylethyl)carbamimidothioate
(1(24DIMETHYLPHENYL)25DIOXOPYRROLIDIN3YL)N(4(CHLORO(DIFLUORO)METHOXY)PHENYL)NPHENETHYLCARBAMIMIDOTHIOATE
1(24dimethylphenyl)25dioxopyrrolidin3ylN(4(chloro(difluoro)methoxy)phenyl)N(2phenylethyl)carbamimidothioate
CC1=CC(=C(C=C1)N2C(=O)CC(C2=O)SC(=NCCC3=CC=CC=C3)NC4=CC=C(C=C4)OC(F)(F)Cl)C
Cc1ccc(c(c1)C)N1C(=O)CC(C1=O)SC(=NCCc1ccccc1)Nc1ccc(cc1)OC(Cl)(F)F
InChI=1SC28H26ClF2N3O3Sc11881323(19(2)1618)3425(35)1724(26(34)36)3827(321514206435720)332191122(121021)3728(2930)31h3131624H141517H212H3(H3233)
MFCD02110692
ZINC000097966142
ZINC000100092298

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Available files

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