Vitas-M small molecule compound
ethyl 2-({[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK836497
SMILES CCOC(=O)c1c(NC(=O)CN2C(=S)S/C(=C\c3ccccc3Cl)/C2=O)sc2c1CCCC2
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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 C23H21ClN2O4S3 MW 521.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O4S3/c1-2-30-22(29)19-14-8-4-6-10-16(14)32-20(19)25-18(27)12-26-21(28)17(33-23(26)31)11-13-7-3-5-9-15(13)24/h3,5,7,9,11H,2,4,6,8,10,12H2,1H3,(H,25,27)/b17-11-InChIKey
BNOXDSHBKOZEHA-BOPFTXTBSA-NSynonyms
301305-06-6(Z)ethyl2(2(5(2chlorobenzylidene)4oxo2thioxothiazolidin3yl)acetamido)4567tetrahydrobenzo(b)thiophene3carboxylate
301305066
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C(=O)C(=CC4=CC=CC=C4Cl)SC3=S
CCOC(=O)c1c(NC(=O)CN2C(=S)SC(=Cc3ccccc3Cl)C2=O)sc2c1CCCC2
ethyl2((((5Z)5(2chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2((5Z)5((2chlorophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H21ClN2O4S3c123022(29)19148461016(14)3220(19)2518(27)122621(28)17(3323(26)31)1113735915(13)24h357911H24681012H21H3(H2527)b1711
MFCD01164324
ZINC000001776414
ZINC01776414
ZINC1776414
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