methyl N-[1-[4-(4-fluoranylphenoxy)butyl]piperidin-4-yl]-N-methyl-N'-phenyl-carbamimidothioate

Systemtic Name: methyl N-[1-[4-(4-fluoranylphenoxy)butyl]piperidin-4-yl]-N-methyl-N'-phenyl-carbamimidothioate Openeye Name: 1-[1-[4-(4-fluorophenoxy)butyl]-4-piperidyl]-1,2-dimethyl-3-phenyl-isothiourea CAS Name: N-[1-[4-(4-fluorophenoxy)butyl]-4-piperidinyl]-N-methyl-N'-phenylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[1-[4-(4-fluorophenoxy)butyl]piperidin-4-yl]-N-methyl-N'-phenylcarbamimidothioate Traditional Name: 1-[1-[4-(4-fluorophenoxy)butyl]-4-piperidyl]-1,2-dimethyl-3-phenyl-isothiourea Formula: C24H32FN3OS MolecularWeight: 429.593783

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)CCCCOC2=CC=C(C=C2)F)C(=NC3=CC=CC=C3)SC

Isomeric SMILES

CN(C1CCN(CC1)CCCCOC2=CC=C(C=C2)F)C(=NC3=CC=CC=C3)SC

InChI

InChI=1S/C24H32FN3OS/c1-27(24(30-2)26-21-8-4-3-5-9-21)22-14-17-28(18-15-22)16-6-7-19-29-23-12-10-20(25)11-13-23/h3-5,8-13,22H,6-7,14-19H2,1-2H3