Vitas-M small molecule compound
ethyl 4-({[3-(pyrrolidin-1-ylcarbonyl)piperidin-1-yl]carbonothioyl}amino)benzoate
Catalog ID
STK732809
SMILES CCOC(=O)c1ccc(cc1)NC(=S)N1CCCC(C1)C(=O)N1CCCC1
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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 C20H27N3O3S MW 389.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O3S/c1-2-26-19(25)15-7-9-17(10-8-15)21-20(27)23-13-5-6-16(14-23)18(24)22-11-3-4-12-22/h7-10,16H,2-6,11-14H2,1H3,(H,21,27)InChIKey
WKGYWACDJDKDEH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCCC(C2)C(=O)N3CCCC3
ETHYL4((((3S)3(PYRROLIDIN1YLCARBONYL)PIPERIDIN1YL)CARBOTHIOYL)AMINO)BENZOATE
ETHYL4(((3(PYRROLIDIN1YLCARBONYL)PIPERIDIN1YL)CARBONOTHIOYL)AMINO)BENZOATE
ETHYL4((3(PYRROLIDINE1CARBONYL)PIPERIDINE1CARBOTHIOYL)AMINO)BENZOATE
InChI=1SC20H27N3O3Sc122619(25)157917(10815)2120(27)23135616(1423)18(24)2211341222h71016H261114H21H3(H2127)
MFCD06013914
ZINC000001443897
ZINC000001443898
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