Vitas-M small molecule compound
1-{4-[chloro(difluoro)methoxy]phenyl}-2,5-dioxopyrrolidin-3-yl N'-heptyl-N-(4-methoxyphenyl)carbamimidothioate
Catalog ID
STK676562
SMILES CCCCCCC/N=C(\SC1CC(=O)N(C1=O)c1ccc(cc1)OC(Cl)(F)F)/Nc1ccc(cc1)OC
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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 C26H30ClF2N3O4S MW 554.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30ClF2N3O4S/c1-3-4-5-6-7-16-30-25(31-18-8-12-20(35-2)13-9-18)37-22-17-23(33)32(24(22)34)19-10-14-21(15-11-19)36-26(27,28)29/h8-15,22H,3-7,16-17H2,1-2H3,(H,30,31)InChIKey
SVDFXGYCKITSEW-UHFFFAOYSA-NSynonyms
(1(4(CHLORO(DIFLUORO)METHOXY)PHENYL)25DIOXOPYRROLIDIN3YL)NHEPTYLN(4METHOXYPHENYL)CARBAMIMIDOTHIOATE
1(4(chloro(difluoro)methoxy)phenyl)25dioxopyrrolidin3ylNheptylN(4methoxyphenyl)carbamimidothioate
CCCCCCCN=C(NC1=CC=C(C=C1)OC)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)OC(F)(F)Cl
CCCCCCCN=C(SC1CC(=O)N(C1=O)c1ccc(cc1)OC(Cl)(F)F)Nc1ccc(cc1)OC
InChI=1SC26H30ClF2N3O4Sc134567163025(311881220(352)13918)37221723(33)32(24(22)34)19101421(151119)3626(2728)29h81522H371617H212H3(H3031)
MFCD02110699
ZINC000098003554
ZINC000100092332
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