Vitas-M small molecule compound
2-{[(E)-(4,6-dioxo-2-thioxohexahydropyrimidin-5-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK066749
SMILES N#Cc1c(/N=C/C2C(=O)NC(=S)NC2=O)sc2c1CCCC2
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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 C14H12N4O2S2 MW 332.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O2S2/c15-5-8-7-3-1-2-4-10(7)22-13(8)16-6-9-11(19)17-14(21)18-12(9)20/h6,9H,1-4H2,(H2,17,18,19,20,21)/b16-6+InChIKey
SDHALMBSHBDFHX-OMCISZLKSA-NSynonyms
2(((E)(46dioxo2thioxohexahydropyrimidin5yl)methylidene)amino)4567tetrahydro1benzothiophene3carbonitrile
2((E)(46dioxo2sulfanylidene13diazinan5yl)methylideneamino)4567tetrahydro1benzothiophene3carbonitrile
C1CCC2=C(C1)C(=C(S2)N=CC3C(=O)NC(=S)NC3=O)C#N
InChI=1SC14H12N4O2S2c15587312410(7)2213(8)166911(19)1714(21)1812(9)20h69H14H2(H21718192021)b166+
MFCD03063507
N#Cc1c(N=CC2C(=O)NC(=S)NC2=O)sc2c1CCCC2
STK066749
ZINC000100508144
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