N-[(4-fluorophenyl)methyl]-1-[3-(3-methylphenyl)sulfanylpyrazin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-1-[3-(3-methylphenyl)sulfanylpyrazin-2-yl]piperidine-4-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-1-[3-(m-tolylsulfanyl)pyrazin-2-yl]piperidine-4-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-1-[3-[(3-methylphenyl)thio]-2-pyrazinyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-1-[3-(3-methylphenyl)sulfanylpyrazin-2-yl]piperidine-4-carboxamide Traditional Name: N-(4-fluorobenzyl)-1-[3-(m-tolylthio)pyrazin-2-yl]isonipecotamide Formula: C24H25FN4OS MolecularWeight: 436.544903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=NC=CN=C2N3CCC(CC3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=CC=C1)SC2=NC=CN=C2N3CCC(CC3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C24H25FN4OS/c1-17-3-2-4-21(15-17)31-24-22(26-11-12-27-24)29-13-9-19(10-14-29)23(30)28-16-18-5-7-20(25)8-6-18/h2-8,11-12,15,19H,9-10,13-14,16H2,1H3,(H,28,30)