Vitas-M small molecule compound
6-({3-[(furan-2-ylmethyl)carbamoyl]thiophen-2-yl}carbamoyl)-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK471657
SMILES O=C(C1CC(=C(CC1C(=O)O)C)C)Nc1sccc1C(=O)NCc1ccco1
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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 C20H22N2O5S MW 402.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O5S/c1-11-8-15(16(20(25)26)9-12(11)2)18(24)22-19-14(5-7-28-19)17(23)21-10-13-4-3-6-27-13/h3-7,15-16H,8-10H2,1-2H3,(H,21,23)(H,22,24)(H,25,26)InChIKey
JUZAYHZVIIUIAT-UHFFFAOYSA-NSynonyms
6((3((furan2ylmethyl)carbamoyl)thiophen2yl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6((3(furan2ylmethylcarbamoyl)thiophen2yl)carbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(N(3(N(2FURYLMETHYL)CARBAMOYL)(2THIENYL))CARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC=CO3)C(=O)O)C
InChI=1SC20H22N2O5Sc111815(16(20(25)26)912(11)2)18(24)221914(572819)17(23)2110134362713h371516H810H212H3(H2123)(H2224)(H2526)
MFCD06026430
ZINC000017082396
ZINC000017082399
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