Vitas-M small molecule compound
4-({(E)-[1-(3-chloro-4-methoxyphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
Catalog ID
STL295808
SMILES CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)N/C=C/1\C(=NN(C1=O)c1ccc(c(c1)Cl)OC)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 C22H21ClN6O4S2 MW 533.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN6O4S2/c1-4-20-25-26-22(34-20)28-35(31,32)16-8-5-14(6-9-16)24-12-17-13(2)27-29(21(17)30)15-7-10-19(33-3)18(23)11-15/h5-12,24H,4H2,1-3H3,(H,26,28)/b17-12+InChIKey
VWHDODKSXKUAMK-SFQUDFHCSA-NSynonyms
4(((E)(1(3chloro4methoxyphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)N(5ethyl134thiadiazol2yl)benzenesulfonamide
4(((E)(1(3chloro4methoxyphenyl)3methyl5oxopyrazol4ylidene)methyl)amino)N(5ethyl134thiadiazol2yl)benzenesulfonamide
CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C(=NN(C3=O)C4=CC(=C(C=C4)OC)Cl)C
CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC=C1C(=NN(C1=O)c1ccc(c(c1)Cl)OC)C
InChI=1SC22H21ClN6O4S2c1420252622(3420)2835(3132)168514(6916)24121713(2)2729(21(17)30)1571019(333)18(23)1115h51224H4H213H3(H2628)b1712+
MFCD28033157
ZINC000101128390
ZINC101128390
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