Vitas-M small molecule compound
ethyl 5-benzyl-2-{[(2-{4-[(2-chlorophenyl)amino]-4-oxobutanoyl}hydrazinyl)carbonothioyl]amino}thiophene-3-carboxylate
Catalog ID
STK460225
SMILES CCOC(=O)c1cc(sc1NC(=S)NNC(=O)CCC(=O)Nc1ccccc1Cl)Cc1ccccc1
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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 C25H25ClN4O4S2 MW 545.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN4O4S2/c1-2-34-24(33)18-15-17(14-16-8-4-3-5-9-16)36-23(18)28-25(35)30-29-22(32)13-12-21(31)27-20-11-7-6-10-19(20)26/h3-11,15H,2,12-14H2,1H3,(H,27,31)(H,29,32)(H2,28,30,35)InChIKey
VZYDMCUKBPTAQY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NNC(=O)CCC(=O)NC3=CC=CC=C3Cl
ETHYL2((((3(N(2CHLOROPHENYL)CARBAMOYL)PROPANOYLAMINO)AMINO)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
ethyl5benzyl2(((2(4((2chlorophenyl)amino)4oxobutanoyl)hydrazinyl)carbonothioyl)amino)thiophene3carboxylate
ETHYL5BENZYL2(((4(2CHLOROANILINO)4OXOBUTANOYL)AMINO)CARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC25H25ClN4O4S2c123424(33)181517(14168435916)3623(18)2825(35)302922(32)131221(31)272011761019(20)26h31115H21214H21H3(H2731)(H2932)(H2283035)
MFCD05990066
ZINC000059603224
ZINC59603224
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