Vitas-M small molecule compound
1-(3,4-dichlorophenyl)-2,5-dioxopyrrolidin-3-yl (2E)-2-{(3E)-4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}hydrazinecarbimidothioate
Catalog ID
STK673569
SMILES N=C(SC1CC(=O)N(C1=O)c1ccc(c(c1)Cl)Cl)N/N=C(/C=C/c1ccc(cc1)N(C)C)\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 C23H23Cl2N5O2S MW 504.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23Cl2N5O2S/c1-14(4-5-15-6-8-16(9-7-15)29(2)3)27-28-23(26)33-20-13-21(31)30(22(20)32)17-10-11-18(24)19(25)12-17/h4-12,20H,13H2,1-3H3,(H2,26,28)/b5-4+,27-14+InChIKey
LYEFLPDXMONOOS-CQFPTCMPSA-NSynonyms
(1(34dichlorophenyl)25dioxopyrrolidin3yl)N((E)((E)4(4(dimethylamino)phenyl)but3en2ylidene)amino)carbamimidothioate
1(34dichlorophenyl)25dioxopyrrolidin3yl(2E)2((3E)4(4(dimethylamino)phenyl)but3en2ylidene)hydrazinecarbimidothioate
CC(=NN=C(N)SC1CC(=O)N(C1=O)C2=CC(=C(C=C2)Cl)Cl)C=CC3=CC=C(C=C3)N(C)C
InChI=1SC23H23Cl2N5O2Sc114(45156816(9715)29(2)3)272823(26)33201321(31)30(22(20)32)17101118(24)19(25)1217h41220H13H213H3(H22628)b54+2714+
MFCD01036550
N=C(SC1CC(=O)N(C1=O)c1ccc(c(c1)Cl)Cl)NN=C(C=Cc1ccc(cc1)N(C)C)C
ZINC000015162863
ZINC000100059369
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