Vitas-M small molecule compound
N-(2-cyanoethyl)-N-[(5-{(Z)-[1-(3,4-dimethylphenyl)-5-oxo-2-thioxoimidazolidin-4-ylidene]methyl}furan-2-yl)methyl]methanesulfonamide
Catalog ID
STK115046
SMILES N#CCCN(S(=O)(=O)C)Cc1ccc(o1)/C=C/1\NC(=S)N(C1=O)c1ccc(c(c1)C)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 C21H22N4O4S2 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S2/c1-14-5-6-16(11-15(14)2)25-20(26)19(23-21(25)30)12-17-7-8-18(29-17)13-24(10-4-9-22)31(3,27)28/h5-8,11-12H,4,10,13H2,1-3H3,(H,23,30)/b19-12-InChIKey
KHRJDRRWYOCWAQ-UNOMPAQXSA-NSynonyms
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)CN(CCC#N)S(=O)(=O)C)NC2=S)C
InChI=1SC21H22N4O4S2c1145616(1115(14)2)2520(26)19(2321(25)30)12177818(2917)1324(104922)31(327)28h581112H41013H213H3(H2330)b1912
MFCD04128426
N#CCCN(S(=O)(=O)C)Cc1ccc(o1)C=C1NC(=S)N(C1=O)c1ccc(c(c1)C)C
N(2CYANOETHYL)N((5((Z)(1(34DIMETHYLPHENYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)FURAN2YL)METHYL)METHANESULFONAMIDE
N(2CYANOETHYL)N((5((Z)(1(34DIMETHYLPHENYL)5OXO2THIOXOIMIDAZOLIDIN4YLIDENE)METHYL)FURAN2YL)METHYL)METHANESULFONAMIDE
ZINC000012628804
ZINC12628804
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