Vitas-M small molecule compound
(5Z)-5-(naphthalen-1-ylmethylidene)-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL438030
SMILES O=C1NC(=S)N(C(=O)/C/1=C\c1cccc2c1cccc2)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 C21H14N2O2S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O2S/c24-19-18(13-15-9-6-8-14-7-4-5-12-17(14)15)20(25)23(21(26)22-19)16-10-2-1-3-11-16/h1-13H,(H,22,24,26)/b18-13-InChIKey
HGYRLQAVCZEEJC-AQTBWJFISA-NSynonyms
(5Z)5(naphthalen1ylmethylidene)1phenyl2sulfanylidene13diazinane46dione
(5Z)5(naphthalen1ylmethylidene)1phenyl2thioxodihydropyrimidine46(1H5H)dione
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CC4=CC=CC=C43)C(=O)NC2=S
InChI=1SC21H14N2O2Sc241918(1315968147451217(14)15)20(25)23(21(26)2219)16102131116h113H(H222426)b1813
MFCD30712047
O=C1NC(=S)N(C(=O)C1=Cc1cccc2c1cccc2)c1ccccc1
ZINC000004456206
ZINC4456206
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