Vitas-M small molecule compound

ethyl 4-[3-(1,3-benzodioxol-5-ylmethyl)-4-{2-[(4-fluorophenyl)amino]-2-oxoethyl}-5-oxo-2-thioxoimidazolidin-1-yl]benzoate

Catalog ID
STK732672
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C(N(C1=S)Cc1ccc2c(c1)OCO2)CC(=O)Nc1ccc(cc1)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 C28H24FN3O6S MW 549.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FN3O6S/c1-2-36-27(35)18-4-10-21(11-5-18)32-26(34)22(14-25(33)30-20-8-6-19(29)7-9-20)31(28(32)39)15-17-3-12-23-24(13-17)38-16-37-23/h3-13,22H,2,14-16H2,1H3,(H,30,33)
InChIKey
PVVBEHGIZXSCAP-UHFFFAOYSA-N
Synonyms
1031705-86-8
1031705868
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CC3=CC4=C(C=C3)OCO4)CC(=O)NC5=CC=C(C=C5)F
ethyl4(3(13benzodioxol5ylmethyl)4(2((4fluorophenyl)amino)2oxoethyl)5oxo2thioxoimidazolidin1yl)benzoate
ETHYL4(3(13BENZODIOXOL5YLMETHYL)4(2(4FLUOROANILINO)2OXOETHYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)BENZOATE
ethyl4(3(benzo(d)(13)dioxol5ylmethyl)4(2((4fluorophenyl)amino)2oxoethyl)5oxo2thioxoimidazolidin1yl)benzoate
InChI=1SC28H24FN3O6Sc123627(35)1841021(11518)3226(34)22(1425(33)30208619(29)7920)31(28(32)39)15173122324(1317)38163723h31322H21416H21H3(H3033)
MFCD03681098
ZINC000001077942
ZINC000097952099

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Available files

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