Vitas-M small molecule compound
N-(2-cyanoethyl)-N-({5-[(4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}methyl)methanesulfonamide
Catalog ID
STL372399
SMILES N#CCCN(S(=O)(=O)C)Cc1ccc(o1)C=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 C14H14N4O5S2 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O5S2/c1-25(21,22)18(6-2-5-15)8-10-4-3-9(23-10)7-11-12(19)16-14(24)17-13(11)20/h3-4,7H,2,6,8H2,1H3,(H2,16,17,19,20,24)InChIKey
KEEIJYGHPAYKOL-UHFFFAOYSA-NSynonyms
CS(=O)(=O)N(CCC#N)CC1=CC=C(O1)C=C2C(=O)NC(=S)NC2=O
InChI=1SC14H14N4O5S2c125(2122)18(62515)810439(2310)71112(19)1614(24)1713(11)20h347H268H21H3(H21617192024)
MFCD03214430
N(2cyanoethyl)N((5((46dioxo2sulfanylidene13diazinan5ylidene)methyl)furan2yl)methyl)methanesulfonamide
N(2cyanoethyl)N((5((46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)methyl)methanesulfonamide
ZINC000096234491
ZINC96234491
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