Vitas-M small molecule compound

(5Z)-1-(3,5-dimethylphenyl)-5-[4-(piperidin-1-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK187973
SMILES Cc1cc(C)cc(c1)N1C(=S)NC(=O)/C(=C/c2ccc(cc2)N2CCCCC2)/C1=O

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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 C24H25N3O2S MW 419.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O2S/c1-16-12-17(2)14-20(13-16)27-23(29)21(22(28)25-24(27)30)15-18-6-8-19(9-7-18)26-10-4-3-5-11-26/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,25,28,30)/b21-15-
InChIKey
KUXBTVGYXBJEDV-QNGOZBTKSA-N
Synonyms

(5Z)1(35DIMETHYLPHENYL)5((4PIPERIDIN1YLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(35DIMETHYLPHENYL)5(4(PIPERIDIN1YL)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
1(35DIMETHYLPHENYL)5(4(1PIPERIDINYL)BENZYLIDENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CC=C(C=C3)N4CCCCC4)C(=O)NC2=S)C
Cc1cc(C)cc(c1)N1C(=S)NC(=O)C(=Cc2ccc(cc2)N2CCCCC2)C1=O
InChI=1SC24H25N3O2Sc1161217(2)1420(1316)2723(29)21(22(28)2524(27)30)15186819(9718)26104351126h691215H351011H212H3(H252830)b2115
MFCD02623997
ZINC000004620690
ZINC04620690
ZINC4620690

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Available files

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