3-(4-fluorophenyl)-2-methylsulfanyl-N-[1-[2-oxidanylidene-2-(propylamino)ethyl]piperidin-4-yl]imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[1-[2-oxidanylidene-2-(propylamino)ethyl]piperidin-4-yl]imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[1-[2-oxo-2-(propylamino)ethyl]-4-piperidyl]imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-2-(methylthio)-N-[1-[2-oxo-2-(propylamino)ethyl]-4-piperidinyl]-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-[1-[2-keto-2-(propylamino)ethyl]-4-piperidyl]-2-(methylthio)imidazole-4-carboxamide Formula: C21H28FN5O2S MolecularWeight: 433.542723

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCC(CC1)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CCCNC(=O)CN1CCC(CC1)NC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H28FN5O2S/c1-3-10-23-19(28)14-26-11-8-16(9-12-26)25-20(29)18-13-24-21(30-2)27(18)17-6-4-15(22)5-7-17/h4-7,13,16H,3,8-12,14H2,1-2H3,(H,23,28)(H,25,29)