Vitas-M small molecule compound
5-{[3-(benzylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]amino}-3-methyl-5-oxopentanoic acid
Catalog ID
STK470747
SMILES OC(=O)CC(CC(=O)Nc1sc2c(c1C(=O)NCc1ccccc1)CCC2)C
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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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-13(11-18(25)26)10-17(24)23-21-19(15-8-5-9-16(15)28-21)20(27)22-12-14-6-3-2-4-7-14/h2-4,6-7,13H,5,8-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)InChIKey
RVILCFUXZKBGNF-UHFFFAOYSA-NSynonyms
3METHYL4(N(3(NBENZYLCARBAMOYL)(456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL))CARBAMOYL)BUTANOICACID
5((3(benzylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)amino)3methyl5oxopentanoicacid
CC(CC(=O)NC1=C(C2=C(S1)CCC2)C(=O)NCC3=CC=CC=C3)CC(=O)O
InChI=1SC21H24N2O4Sc113(1118(25)26)1017(24)232119(1585916(15)2821)20(27)2212146324714h246713H5812H21H3(H2227)(H2324)(H2526)
MFCD06021697
ZINC000017081941
ZINC000017081942
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