4-(2-cyclopentylethyl)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-(2-cyclopentylethyl)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(4-tert-butoxycarbonylpiperazin-1-yl)-4-(2-cyclopentylethyl)thiazole-5-carboxylic acid CAS Name: 4-(2-cyclopentylethyl)-2-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-5-thiazolecarboxylic acid IUPAC Name: 4-(2-cyclopentylethyl)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(4-tert-butoxycarbonylpiperazino)-4-(2-cyclopentylethyl)thiazole-5-carboxylic acid Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=C(S2)C(=O)O)CCC3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=C(S2)C(=O)O)CCC3CCCC3

InChI

InChI=1S/C20H31N3O4S/c1-20(2,3)27-19(26)23-12-10-22(11-13-23)18-21-15(16(28-18)17(24)25)9-8-14-6-4-5-7-14/h14H,4-13H2,1-3H3,(H,24,25)