Vitas-M small molecule compound
4-({3-[(4-ethoxyphenyl)carbamoyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl}amino)-4-oxobutanoic acid
Catalog ID
STK377599
SMILES CCOc1ccc(cc1)NC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCC2
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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/c1-2-27-13-8-6-12(7-9-13)21-19(26)18-14-4-3-5-15(14)28-20(18)22-16(23)10-11-17(24)25/h6-9H,2-5,10-11H2,1H3,(H,21,26)(H,22,23)(H,24,25)InChIKey
BXPKZWSAHGGGLC-UHFFFAOYSA-NSynonyms
3(N(3(N(4ETHOXYPHENYL)CARBAMOYL)456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL)CARBAMOYL)PROPANOICACID
4((3((4ethoxyphenyl)carbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)amino)4oxobutanoicacid
CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC3)NC(=O)CCC(=O)O
InChI=1SC20H22N2O5Sc1227138612(7913)2119(26)181443515(14)2820(18)2216(23)101117(24)25h69H251011H21H3(H2126)(H2223)(H2425)
MFCD01989482
ZINC000004195857
ZINC4195857
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