methyl 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-5-(3-methoxypropylcarbamoylamino)-2-piperidin-1-yl-imidazole-4-carboxylate

Systemtic Name: methyl 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-5-(3-methoxypropylcarbamoylamino)-2-piperidin-1-yl-imidazole-4-carboxylate Openeye Name: methyl 3-[(2-chloro-6-fluoro-phenyl)methyl]-5-(3-methoxypropylcarbamoylamino)-2-(1-piperidyl)imidazole-4-carboxylate CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-5-[[(3-methoxypropylamino)-oxomethyl]amino]-2-(1-piperidinyl)-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-6-fluorophenyl)methyl]-5-(3-methoxypropylcarbamoylamino)-2-piperidin-1-ylimidazole-4-carboxylate Traditional Name: 3-(2-chloro-6-fluoro-benzyl)-5-(3-methoxypropylcarbamoylamino)-2-piperidino-imidazole-4-carboxylic acid methyl ester Formula: C22H29ClFN5O4 MolecularWeight: 481.948163

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)NC1=C(N(C(=N1)N2CCCCC2)CC3=C(C=CC=C3Cl)F)C(=O)OC

Isomeric SMILES

COCCCNC(=O)NC1=C(N(C(=N1)N2CCCCC2)CC3=C(C=CC=C3Cl)F)C(=O)OC

InChI

InChI=1S/C22H29ClFN5O4/c1-32-13-7-10-25-21(31)26-19-18(20(30)33-2)29(14-15-16(23)8-6-9-17(15)24)22(27-19)28-11-4-3-5-12-28/h6,8-9H,3-5,7,10-14H2,1-2H3,(H2,25,26,31)