N-(2-dimethylaminoethyl)-N-[[1-[(2-fluorophenyl)methyl]piperidin-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-[[1-[(2-fluorophenyl)methyl]piperidin-3-yl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-N-[[1-[(2-fluorophenyl)methyl]-3-piperidyl]methyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-(2-dimethylaminoethyl)-N-[[1-[(2-fluorophenyl)methyl]-3-piperidinyl]methyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-N-[[1-[(2-fluorophenyl)methyl]piperidin-3-yl]methyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-N-[[1-(2-fluorobenzyl)-3-piperidyl]methyl]-2-(methylthio)nicotinamide Formula: C24H33FN4OS MolecularWeight: 444.608423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1CCCN(C1)CC2=CC=CC=C2F)C(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CN(C)CCN(CC1CCCN(C1)CC2=CC=CC=C2F)C(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C24H33FN4OS/c1-27(2)14-15-29(24(30)21-10-6-12-26-23(21)31-3)17-19-8-7-13-28(16-19)18-20-9-4-5-11-22(20)25/h4-6,9-12,19H,7-8,13-18H2,1-3H3