Vitas-M small molecule compound
6-({3-[(furan-2-ylmethyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK471253
SMILES O=C(C1CC=CCC1C(=O)O)Nc1sc2c(c1C(=O)NCc1ccco1)CCC2
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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 C21H22N2O5S MW 414.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5S/c24-18(13-6-1-2-7-14(13)21(26)27)23-20-17(15-8-3-9-16(15)29-20)19(25)22-11-12-5-4-10-28-12/h1-2,4-5,10,13-14H,3,6-9,11H2,(H,22,25)(H,23,24)(H,26,27)InChIKey
XPCIEODDRXWCBW-UHFFFAOYSA-NSynonyms
6((3((furan2ylmethyl)carbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3(furan2ylmethylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6(N(3(N(2FURYLMETHYL)CARBAMOYL)456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
C1CC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C4CC=CCC4C(=O)O
InChI=1SC21H22N2O5Sc2418(13612714(13)21(26)27)232017(1583916(15)2920)19(25)22111254102812h1245101314H36911H2(H2225)(H2324)(H2627)
MFCD06025569
ZINC000017089855
ZINC000017089858
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