Vitas-M small molecule compound
2-{[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
Catalog ID
STL295710
SMILES N#Cc1c(NC=C2C(=O)NC(=S)NC2=O)sc2c1CCC2
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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 C13H10N4O2S2 MW 318.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N4O2S2/c14-4-7-6-2-1-3-9(6)21-12(7)15-5-8-10(18)16-13(20)17-11(8)19/h5,15H,1-3H2,(H2,16,17,18,19,20)InChIKey
IZRIBQPBZGKPJZ-UHFFFAOYSA-NSynonyms
2(((46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)56dihydro4Hcyclopenta(b)thiophene3carbonitrile
2((46dioxo2sulfanylidene13diazinan5ylidene)methylamino)56dihydro4Hcyclopenta(b)thiophene3carbonitrile
C1CC2=C(C1)SC(=C2C#N)NC=C3C(=O)NC(=S)NC3=O
InChI=1SC13H10N4O2S2c144762139(6)2112(7)155810(18)1613(20)1711(8)19h515H13H2(H21617181920)
MFCD01132991
ZINC000029006237
ZINC29006237
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