Vitas-M small molecule compound
N-(2-cyanoethyl)-N-({5-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}methyl)methanesulfonamide
Catalog ID
STL375862
SMILES N#CCCN(S(=O)(=O)C)Cc1ccc(o1)C=C1C(=O)N(C)C(=S)N(C1=O)C
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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 C16H18N4O5S2 MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O5S2/c1-18-14(21)13(15(22)19(2)16(18)26)9-11-5-6-12(25-11)10-20(8-4-7-17)27(3,23)24/h5-6,9H,4,8,10H2,1-3H3InChIKey
ASSHRYJMFYPOBP-UHFFFAOYSA-NSynonyms
CN1C(=O)C(=CC2=CC=C(O2)CN(CCC#N)S(=O)(=O)C)C(=O)N(C1=S)C
InChI=1SC16H18N4O5S2c11814(21)13(15(22)19(2)16(18)26)9115612(2511)1020(84717)27(323)24h569H4810H213H3
MFCD03214429
N(2cyanoethyl)N((5((13dimethyl46dioxo2sulfanylidene13diazinan5ylidene)methyl)furan2yl)methyl)methanesulfonamide
N(2cyanoethyl)N((5((13dimethyl46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)methyl)methanesulfonamide
ZINC000059182376
ZINC59182376
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