2-[2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]ethylsulfanyl]-1H-imidazole-5-carboxylic acid

Systemtic Name: 2-[2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]ethylsulfanyl]-1H-imidazole-5-carboxylic acid Openeye Name: 2-[2-(1-tert-butoxycarbonyl-4-piperidyl)ethylsulfanyl]-1H-imidazole-5-carboxylic acid CAS Name: 2-[2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinyl]ethylthio]-1H-imidazole-5-carboxylic acid IUPAC Name: 2-[2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]ethylsulfanyl]-1H-imidazole-5-carboxylic acid Traditional Name: 2-[2-(1-tert-butoxycarbonyl-4-piperidyl)ethylthio]-1H-imidazole-5-carboxylic acid Formula: C16H25N3O4S MolecularWeight: 355.4524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCSC2=NC=C(N2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCSC2=NC=C(N2)C(=O)O

InChI

InChI=1S/C16H25N3O4S/c1-16(2,3)23-15(22)19-7-4-11(5-8-19)6-9-24-14-17-10-12(18-14)13(20)21/h10-11H,4-9H2,1-3H3,(H,17,18)(H,20,21)