Vitas-M small molecule compound

(5E)-5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-1-phenyl-3-propyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK198018
SMILES CCCN1C(=O)/C(=C\c2cc(c(o2)Sc2ccc(cc2)Cl)Br)/C(=O)N(C1=S)c1ccccc1

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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 C24H18BrClN2O3S2 MW 561.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18BrClN2O3S2/c1-2-12-27-21(29)19(22(30)28(24(27)32)16-6-4-3-5-7-16)13-17-14-20(25)23(31-17)33-18-10-8-15(26)9-11-18/h3-11,13-14H,2,12H2,1H3/b19-13+
InChIKey
DHPOTQMGWZXOPJ-CPNJWEJPSA-N
Synonyms

(5E)5((4BROMO5((4CHLOROPHENYL)SULFANYL)FURAN2YL)METHYLIDENE)1PHENYL3PROPYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)5((4bromo5(4chlorophenyl)sulfanylfuran2yl)methylidene)1phenyl3propyl2sulfanylidene13diazinane46dione
CCCN1C(=O)C(=CC2=CC(=C(O2)SC3=CC=C(C=C3)Cl)Br)C(=O)N(C1=S)C4=CC=CC=C4
CCCN1C(=O)C(=Cc2cc(c(o2)Sc2ccc(cc2)Cl)Br)C(=O)N(C1=S)c1ccccc1
InChI=1SC24H18BrClN2O3S2c12122721(29)19(22(30)28(24(27)32)166435716)13171420(25)23(3117)331810815(26)91118h3111314H212H21H3b1913+
MFCD04307927
ZINC000097960832
ZINC97960832

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Available files

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