Vitas-M small molecule compound
ethyl 5-benzyl-2-{[(4-benzylpiperazin-1-yl)carbonothioyl]amino}thiophene-3-carboxylate
Catalog ID
STK436692
SMILES CCOC(=O)c1cc(sc1NC(=S)N1CCN(CC1)Cc1ccccc1)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 C26H29N3O2S2 MW 479.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O2S2/c1-2-31-25(30)23-18-22(17-20-9-5-3-6-10-20)33-24(23)27-26(32)29-15-13-28(14-16-29)19-21-11-7-4-8-12-21/h3-12,18H,2,13-17,19H2,1H3,(H,27,32)InChIKey
NKFAGOGNGAXIJI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)N3CCN(CC3)CC4=CC=CC=C4
ethyl5benzyl2(((4benzylpiperazin1yl)carbonothioyl)amino)thiophene3carboxylate
ETHYL5BENZYL2(((4BENZYLPIPERAZINYL)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5BENZYL2((4BENZYLPIPERAZINE1CARBOTHIOYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC26H29N3O2S2c123125(30)231822(172095361020)3324(23)2726(32)29151328(141629)1921117481221h31218H2131719H21H3(H2732)
MFCD03945109
ZINC000020168647
ZINC20168647
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