Vitas-M small molecule compound
N,N-dimethyl-3-(4-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1-phenyl-1H-pyrazol-3-yl)benzenesulfonamide
Catalog ID
STK905057
SMILES S=C1S/C(=C\c2cn(nc2c2cccc(c2)S(=O)(=O)N(C)C)c2ccccc2)/C(=O)N1CC1CCCO1
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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 C26H26N4O4S3 MW 554.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O4S3/c1-28(2)37(32,33)22-12-6-8-18(14-22)24-19(16-30(27-24)20-9-4-3-5-10-20)15-23-25(31)29(26(35)36-23)17-21-11-7-13-34-21/h3-6,8-10,12,14-16,21H,7,11,13,17H2,1-2H3/b23-15-InChIKey
LAXFUYDCYDGAKO-HAHDFKILSA-NSynonyms
(Z)NNdimethyl3(4((4oxo3((tetrahydrofuran2yl)methyl)2thioxothiazolidin5ylidene)methyl)1phenyl1Hpyrazol3yl)benzenesulfonamide
CN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4CCCO4)C5=CC=CC=C5
InChI=1SC26H26N4O4S3c128(2)37(3233)22126818(1422)2419(1630(2724)2094351020)152325(31)29(26(35)3623)1721117133421h3681012141621H7111317H212H3b2315
MFCD04174857
NNDIMETHYL3(4((Z)(4OXO3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)1PHENYLPYRAZOL3YL)BENZENESULFONAMIDE
NNdimethyl3(4((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)1phenyl1Hpyrazol3yl)benzenesulfonamide
ZINC000097961039
ZINC000097961040
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