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

Systemtic Name: 1-[3-(3-methylphenyl)sulfanylpyrazin-2-yl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[3-(m-tolylsulfanyl)pyrazin-2-yl]piperidine-4-carboxamide CAS Name: 1-[3-[(3-methylphenyl)thio]-2-pyrazinyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[3-(3-methylphenyl)sulfanylpyrazin-2-yl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[3-(m-tolylthio)pyrazin-2-yl]isonipecotamide Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26N4OS/c1-18-6-5-9-21(16-18)30-24-22(25-12-13-26-24)28-14-10-20(11-15-28)23(29)27-17-19-7-3-2-4-8-19/h2-9,12-13,16,20H,10-11,14-15,17H2,1H3,(H,27,29)