Vitas-M small molecule compound
5,5'-[benzene-1,3-diylbis(iminomethylylidene)]bis(2-thioxodihydropyrimidine-4,6(1H,5H)-dione)
Catalog ID
STL415795
SMILES O=C1NC(=S)NC(=O)C1=CNc1cccc(c1)NC=C1C(=O)NC(=S)NC1=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 C16H12N6O4S2 MW 416.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6O4S2/c23-11-9(12(24)20-15(27)19-11)5-17-7-2-1-3-8(4-7)18-6-10-13(25)21-16(28)22-14(10)26/h1-6,17-18H,(H2,19,20,23,24,27)(H2,21,22,25,26,28)InChIKey
WEJNMXKOKKAPLE-UHFFFAOYSA-NSynonyms
5(((3(((46DIOXO2THIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)AMINO)PHENYL)AMINO)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
5((3((46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYLAMINO)ANILINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
55(benzene13diylbis(iminomethylylidene))bis(2thioxodihydropyrimidine46(1H5H)dione)
C1=CC(=CC(=C1)NC=C2C(=O)NC(=S)NC2=O)NC=C3C(=O)NC(=S)NC3=O
InChI=1SC16H12N6O4S2c23119(12(24)2015(27)1911)51772138(47)1861013(25)2116(28)2214(10)26h161718H(H21920232427)(H22122252628)
MFCD00697069
ZINC000003066976
ZINC03066976
ZINC3066976
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