ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H23FN4O3S MolecularWeight: 406.474323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C19H23FN4O3S/c1-3-27-19(26)23-10-8-14(9-11-23)22-17(25)16-12-21-18(28-2)24(16)15-6-4-13(20)5-7-15/h4-7,12,14H,3,8-11H2,1-2H3,(H,22,25)