Vitas-M small molecule compound
butyl 4-({[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)benzoate
Catalog ID
STK918427
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)CN1C(=S)S/C(=C\c2cccs2)/C1=O
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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 C21H20N2O4S3 MW 460.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4S3/c1-2-3-10-27-20(26)14-6-8-15(9-7-14)22-18(24)13-23-19(25)17(30-21(23)28)12-16-5-4-11-29-16/h4-9,11-12H,2-3,10,13H2,1H3,(H,22,24)/b17-12-InChIKey
YPNJJACLKZNXFU-ATVHPVEESA-NSynonyms
butyl4((((5Z)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)acetyl)amino)benzoate
BUTYL4((2((5Z)4OXO2SULFANYLIDENE5(THIOPHEN2YLMETHYLIDENE)13THIAZOLIDIN3YL)ACETYL)AMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=CS3)SC2=S
CCCCOC(=O)c1ccc(cc1)NC(=O)CN1C(=S)SC(=Cc2cccs2)C1=O
InChI=1SC21H20N2O4S3c123102720(26)146815(9714)2218(24)132319(25)17(3021(23)28)121654112916h491112H231013H21H3(H2224)b1712
MFCD08143725
ZINC000001859943
ZINC01859943
ZINC1859943
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