Vitas-M small molecule compound

(5Z)-5-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-1-(1,1-dioxidotetrahydrothiophen-3-yl)-2,6-dioxo-4-phenyl-1,2,5,6-tetrahydropyridine-3-carbonitrile

Catalog ID
STK908178
SMILES N#CC1=C(c2ccccc2)/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)Cl)/C(=O)N(C1=O)C1CCS(=O)(=O)C1

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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 C27H18Cl2N2O5S MW 553.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18Cl2N2O5S/c28-22-8-6-17(12-23(22)29)24-9-7-19(36-24)13-20-25(16-4-2-1-3-5-16)21(14-30)27(33)31(26(20)32)18-10-11-37(34,35)15-18/h1-9,12-13,18H,10-11,15H2/b20-13-
InChIKey
STXUEXBIIWLYLK-MOSHPQCFSA-N
Synonyms

(5Z)5((5(34dichlorophenyl)furan2yl)methylidene)1(11dioxidotetrahydrothiophen3yl)26dioxo4phenyl1256tetrahydropyridine3carbonitrile
(5Z)5((5(34dichlorophenyl)furan2yl)methylidene)1(11dioxothiolan3yl)26dioxo4phenylpyridine3carbonitrile
C1CS(=O)(=O)CC1N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)Cl)C(=C(C2=O)C#N)C5=CC=CC=C5
InChI=1SC27H18Cl2N2O5Sc28228617(1223(22)29)249719(3624)132025(164213516)21(1430)27(33)31(26(20)32)18101137(3435)1518h19121318H101115H2b2013
MFCD06651383
N#CC1=C(c2ccccc2)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)Cl)C(=O)N(C1=O)C1CCS(=O)(=O)C1
ZINC000097946877
ZINC000097946878

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Available files

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