Vitas-M small molecule compound
(5Z)-1-(4-ethylphenyl)-5-[4-(piperidin-1-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188061
SMILES CCc1ccc(cc1)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/c1-2-17-6-12-20(13-7-17)27-23(29)21(22(28)25-24(27)30)16-18-8-10-19(11-9-18)26-14-4-3-5-15-26/h6-13,16H,2-5,14-15H2,1H3,(H,25,28,30)/b21-16-InChIKey
NIYSAPJIYBBENI-PGMHBOJBSA-NSynonyms
(5Z)1(4ETHYLPHENYL)5((4PIPERIDIN1YLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)1(4ETHYLPHENYL)5(4(PIPERIDIN1YL)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
1(4ETHYLPHENYL)5(4(1PIPERIDINYL)BENZYLIDENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)N4CCCCC4)C(=O)NC2=S
CCc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2ccc(cc2)N2CCCCC2)C1=O
InChI=1SC24H25N3O2Sc121761220(13717)2723(29)21(22(28)2524(27)30)161881019(11918)26144351526h61316H251415H21H3(H252830)b2116
MFCD02773264
ZINC000004620688
ZINC04620688
ZINC4620688
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