Vitas-M small molecule compound
ethyl 2-({[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonothioyl}amino)benzoate
Catalog ID
STL145345
SMILES CCOC(=O)c1ccccc1NC(=S)N1CCN(CC1)c1cccc(c1C)C
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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 C22H27N3O2S MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O2S/c1-4-27-21(26)18-9-5-6-10-19(18)23-22(28)25-14-12-24(13-15-25)20-11-7-8-16(2)17(20)3/h5-11H,4,12-15H2,1-3H3,(H,23,28)InChIKey
GYCQJKLHVGECLP-UHFFFAOYSA-NSynonyms
892274-65-6892274656
CCOC(=O)C1=CC=CC=C1NC(=S)N2CCN(CC2)C3=CC=CC(=C3C)C
ethyl2(((4(23dimethylphenyl)piperazin1yl)carbonothioyl)amino)benzoate
ethyl2((4(23dimethylphenyl)piperazine1carbothioyl)amino)benzoate
InChI=1SC22H27N3O2Sc142721(26)189561019(18)2322(28)25141224(131525)20117816(2)17(20)3h511H41215H213H3(H2328)
MFCD14726259
ZINC000004767823
ZINC4767823
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