Vitas-M small molecule compound
ethyl 5-benzyl-2-({[4-(methylsulfonyl)piperazin-1-yl]carbonothioyl}amino)thiophene-3-carboxylate
Catalog ID
STK457392
SMILES CCOC(=O)c1cc(sc1NC(=S)N1CCN(CC1)S(=O)(=O)C)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 C20H25N3O4S3 MW 467.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O4S3/c1-3-27-19(24)17-14-16(13-15-7-5-4-6-8-15)29-18(17)21-20(28)22-9-11-23(12-10-22)30(2,25)26/h4-8,14H,3,9-13H2,1-2H3,(H,21,28)InChIKey
QUOFFKMZNIPHIF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)N3CCN(CC3)S(=O)(=O)C
ETHYL2(((4(METHYLSULFONYL)PIPERAZINYL)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
ethyl5benzyl2(((4(methylsulfonyl)piperazin1yl)carbonothioyl)amino)thiophene3carboxylate
ETHYL5BENZYL2((4METHYLSULFONYLPIPERAZINE1CARBOTHIOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC20H25N3O4S3c132719(24)171416(13157546815)2918(17)2120(28)2291123(121022)30(225)26h4814H3913H212H3(H2128)
MFCD04137194
ZINC000016346129
ZINC16346129
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