Vitas-M small molecule compound
1-(3-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl (2E)-2-[1-(4-fluorophenyl)ethylidene]hydrazinecarbimidothioate
Catalog ID
STK758781
SMILES COc1cccc(c1)N1C(=O)CC(C1=O)SC(=N)N/N=C(/c1ccc(cc1)F)\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 C20H19FN4O3S MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19FN4O3S/c1-12(13-6-8-14(21)9-7-13)23-24-20(22)29-17-11-18(26)25(19(17)27)15-4-3-5-16(10-15)28-2/h3-10,17H,11H2,1-2H3,(H2,22,24)/b23-12+InChIKey
TWQPWGMFSGJHGA-FSJBWODESA-NSynonyms
(1(3methoxyphenyl)25dioxopyrrolidin3yl)N((E)1(4fluorophenyl)ethylideneamino)carbamimidothioate
1(3methoxyphenyl)25dioxopyrrolidin3yl(2E)2(1(4fluorophenyl)ethylidene)hydrazinecarbimidothioate
CC(=NN=C(N)SC1CC(=O)N(C1=O)C2=CC(=CC=C2)OC)C3=CC=C(C=C3)F
COc1cccc(c1)N1C(=O)CC(C1=O)SC(=N)NN=C(c1ccc(cc1)F)C
InChI=1SC20H19FN4O3Sc112(136814(21)9713)232420(22)29171118(26)25(19(17)27)1543516(1015)282h31017H11H212H3(H22224)b2312+
MFCD01036528
ZINC000004188765
ZINC000100070787
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