Vitas-M small molecule compound
ethyl 2-{[(2-chlorobenzyl)carbamothioyl]amino}-5-phenylthiophene-3-carboxylate
Catalog ID
STK438656
SMILES CCOC(=O)c1cc(sc1NC(=S)NCc1ccccc1Cl)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 C21H19ClN2O2S2 MW 430.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O2S2/c1-2-26-20(25)16-12-18(14-8-4-3-5-9-14)28-19(16)24-21(27)23-13-15-10-6-7-11-17(15)22/h3-12H,2,13H2,1H3,(H2,23,24,27)InChIKey
XFDBLGMANOMPQE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NCC3=CC=CC=C3Cl
ETHYL2(((((2CHLOROPHENYL)METHYL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl2(((2chlorobenzyl)carbamothioyl)amino)5phenylthiophene3carboxylate
ETHYL2((2CHLOROPHENYL)METHYLCARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H19ClN2O2S2c122620(25)161218(148435914)2819(16)2421(27)23131510671117(15)22h312H213H21H3(H2232427)
MFCD03945618
ZINC000017097304
ZINC17097304
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