Vitas-M small molecule compound
ethyl 4-({[2-(1H-indol-3-yl)-2-phenylethyl]carbamothioyl}amino)benzoate
Catalog ID
STK174898
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NCC(c1c[nH]c2c1cccc2)c1ccccc1
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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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-2-31-25(30)19-12-14-20(15-13-19)29-26(32)28-16-22(18-8-4-3-5-9-18)23-17-27-24-11-7-6-10-21(23)24/h3-15,17,22,27H,2,16H2,1H3,(H2,28,29,32)InChIKey
XAHMTUJMBYRLDO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC(C2=CC=CC=C2)C3=CNC4=CC=CC=C43
CCOC(=O)c1ccc(cc1)NC(=S)NCC(c1c(nH)c2c1cccc2)c1ccccc1
ETHYL4((((2S)2(1HINDOL3YL)2PHENYLETHYL)CARBAMOTHIOYL)AMINO)BENZOATE
ETHYL4(((2(1HINDOL3YL)2PHENYLETHYL)CARBAMOTHIOYL)AMINO)BENZOATE
ETHYL4((2(1HINDOL3YL)2PHENYLETHYL)CARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC26H25N3O2Sc123125(30)19121420(151319)2926(32)281622(188435918)2317272411761021(23)24h315172227H216H21H3(H2282932)
MFCD05859942
ZINC000001070110
ZINC000001070112
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