Vitas-M small molecule compound
3-methyl-5-({3-[(4-methylphenyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}amino)-5-oxopentanoic acid
Catalog ID
STK471027
SMILES OC(=O)CC(CC(=O)Nc1sc2c(c1C(=O)Nc1ccc(cc1)C)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/c1-12-6-8-14(9-7-12)22-20(27)19-15-4-3-5-16(15)28-21(19)23-17(24)10-13(2)11-18(25)26/h6-9,13H,3-5,10-11H2,1-2H3,(H,22,27)(H,23,24)(H,25,26)InChIKey
MKVYFXWXLVRSGA-UHFFFAOYSA-NSynonyms
3METHYL4(N(3(N(4METHYLPHENYL)CARBAMOYL)(456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL))CARBAMOYL)BUTANOICACID
3methyl5((3((4methylphenyl)carbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)amino)5oxopentanoicacid
CC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC3)NC(=O)CC(C)CC(=O)O
InChI=1SC21H24N2O4Sc1126814(9712)2220(27)191543516(15)2821(19)2317(24)1013(2)1118(25)26h6913H351011H212H3(H2227)(H2324)(H2526)
MFCD06023427
ZINC000017081986
ZINC000017081987
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