Vitas-M small molecule compound
ethyl 4-{[2-(1H-benzimidazol-2-ylsulfanyl)butanoyl]amino}benzoate
Catalog ID
STK209079
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C(Sc1nc2c([nH]1)cccc2)CC
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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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-3-17(27-20-22-15-7-5-6-8-16(15)23-20)18(24)21-14-11-9-13(10-12-14)19(25)26-4-2/h5-12,17H,3-4H2,1-2H3,(H,21,24)(H,22,23)InChIKey
HTFUNWVMDGELAI-UHFFFAOYSA-NSynonyms
713080-80-9713080809
CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)SC2=NC3=CC=CC=C3N2
CCOC(=O)c1ccc(cc1)NC(=O)C(Sc1nc2c((nH)1)cccc2)CC
ETHYL4(((2R)2(1HBENZIMIDAZOL2YLSULFANYL)BUTANOYL)AMINO)BENZOATE
ETHYL4(((2S)2(1HBENZIMIDAZOL2YLSULFANYL)BUTANOYL)AMINO)BENZOATE
ETHYL4((2(1HBENZIMIDAZOL2YLSULFANYL)BUTANOYL)AMINO)BENZOATE
ETHYL4(2(1HBENZIMIDAZOL2YLSULFANYL)BUTANOYLAMINO)BENZOATE
ETHYL4(2BENZIMIDAZOL2YLTHIOBUTANOYLAMINO)BENZOATE
InChI=1SC20H21N3O3Sc1317(27202215756816(15)2320)18(24)211411913(101214)19(25)2642h51217H34H212H3(H2124)(H2223)
MFCD05998074
ZINC000001072022
ZINC000001072025
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