Vitas-M small molecule compound
4-[(E)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 4-methylbenzoate
Catalog ID
STK809184
SMILES CCCCN1C(=S)S/C(=C/c2ccc(cc2)OC(=O)c2ccc(cc2)C)/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 C22H21NO3S2 MW 411.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO3S2/c1-3-4-13-23-20(24)19(28-22(23)27)14-16-7-11-18(12-8-16)26-21(25)17-9-5-15(2)6-10-17/h5-12,14H,3-4,13H2,1-2H3/b19-14+InChIKey
OANWZDJCSXPKLO-XMHGGMMESA-NSynonyms
(4((E)(3BUTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)4METHYLBENZOATE
4((E)(3butyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl4methylbenzoate
CCCCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)SC1=S
CCCCN1C(=S)SC(=Cc2ccc(cc2)OC(=O)c2ccc(cc2)C)C1=O
InChI=1SC22H21NO3S2c134132320(24)19(2822(23)27)141671118(12816)2621(25)179515(2)61017h51214H3413H212H3b1914+
MFCD03461244
ZINC000016790600
ZINC16790600
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