Vitas-M small molecule compound
ethyl 4-({[4-(pyrrolidin-1-ylcarbonyl)phenyl]carbamothioyl}amino)benzoate
Catalog ID
STK456923
SMILES CCOC(=O)c1ccc(cc1)NC(=S)Nc1ccc(cc1)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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c1-2-27-20(26)16-7-11-18(12-8-16)23-21(28)22-17-9-5-15(6-10-17)19(25)24-13-3-4-14-24/h5-12H,2-4,13-14H2,1H3,(H2,22,23,28)InChIKey
XKXYXZYQXWLKGR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCC3
ETHYL4((((4(PYRROLIDINYLCARBONYL)PHENYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
ethyl4(((4(pyrrolidin1ylcarbonyl)phenyl)carbamothioyl)amino)benzoate
ETHYL4((4(PYRROLIDINE1CARBONYL)PHENYL)CARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC21H23N3O3Sc122720(26)1671118(12816)2321(28)22179515(61017)19(25)2413341424h512H241314H21H3(H2222328)
MFCD04220256
ZINC000001119383
ZINC01119383
ZINC1119383
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