Vitas-M small molecule compound
(5E)-5-{[5-(azepan-1-yl)furan-2-yl]methylidene}-1-(2,4-dimethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK189502
SMILES Cc1ccc(c(c1)C)N1C(=S)NC(=O)/C(=C\c2ccc(o2)N2CCCCCC2)/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 C23H25N3O3S MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O3S/c1-15-7-9-19(16(2)13-15)26-22(28)18(21(27)24-23(26)30)14-17-8-10-20(29-17)25-11-5-3-4-6-12-25/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,24,27,30)/b18-14+InChIKey
WYPYFGJDSTTYGU-NBVRZTHBSA-NSynonyms
(5E)5((5(AZEPAN1YL)FURAN2YL)METHYLIDENE)1(24DIMETHYLPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((5(AZEPAN1YL)FURAN2YL)METHYLIDENE)1(24DIMETHYLPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((5(1AZEPANYL)2FURYL)METHYLENE)1(24DIMETHYLPHENYL)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CC1=CC(=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)N4CCCCCC4)C(=O)NC2=S)C
Cc1ccc(c(c1)C)N1C(=S)NC(=O)C(=Cc2ccc(o2)N2CCCCCC2)C1=O
InChI=1SC23H25N3O3Sc1157919(16(2)1315)2622(28)18(21(27)2423(26)30)141781020(2917)251153461225h7101314H361112H212H3(H242730)b1814+
MFCD04089296
ZINC000000664866
ZINC00664866
ZINC664866
Check stock
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