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

Systemtic Name: N-cyclopentyl-1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]piperidine-3-carboxamide Openeye Name: N-cyclopentyl-1-[3-(p-tolylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide CAS Name: N-cyclopentyl-1-[3-[(4-methylphenyl)thio]-2-pyrazinyl]-3-piperidinecarboxamide IUPAC Name: N-cyclopentyl-1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]piperidine-3-carboxamide Traditional Name: N-cyclopentyl-1-[3-(p-tolylthio)pyrazin-2-yl]nipecotamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NC4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NC4CCCC4

InChI

InChI=1S/C22H28N4OS/c1-16-8-10-19(11-9-16)28-22-20(23-12-13-24-22)26-14-4-5-17(15-26)21(27)25-18-6-2-3-7-18/h8-13,17-18H,2-7,14-15H2,1H3,(H,25,27)