Vitas-M small molecule compound
(5Z)-1-(2,3-dichlorophenyl)-2-thioxo-5-[(1,2,5-trimethyl-1H-pyrrol-3-yl)methylidene]dihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK193131
SMILES S=C1NC(=O)/C(=C/c2cc(n(c2C)C)C)/C(=O)N1c1cccc(c1Cl)Cl
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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 C18H15Cl2N3O2S MW 408.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Cl2N3O2S/c1-9-7-11(10(2)22(9)3)8-12-16(24)21-18(26)23(17(12)25)14-6-4-5-13(19)15(14)20/h4-8H,1-3H3,(H,21,24,26)/b12-8-InChIKey
DNGXZUNKRHKDHZ-WQLSENKSSA-NSynonyms
(5Z)1(23DICHLOROPHENYL)2SULFANYL5((125TRIMETHYL1HPYRROL3YL)METHYLIDENE)PYRIMIDINE46(1H5H)DIONE
(5Z)1(23DICHLOROPHENYL)2SULFANYLIDENE5((125TRIMETHYLPYRROL3YL)METHYLIDENE)13DIAZINANE46DIONE
(5Z)1(23DICHLOROPHENYL)2THIOXO5((125TRIMETHYL1HPYRROL3YL)METHYLIDENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
(Z)1(23dichlorophenyl)2thioxo5((125trimethyl1Hpyrrol3yl)methylene)dihydropyrimidine46(1H5H)dione
CC1=CC(=C(N1C)C)C=C2C(=O)NC(=S)N(C2=O)C3=C(C(=CC=C3)Cl)Cl
InChI=1SC18H15Cl2N3O2Sc19711(10(2)22(9)3)81216(24)2118(26)23(17(12)25)1464513(19)15(14)20h48H13H3(H212426)b128
MFCD02379654
S=C1NC(=O)C(=Cc2cc(n(c2C)C)C)C(=O)N1c1cccc(c1Cl)Cl
ZINC13551147
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.