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

Systemtic Name: 1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]-N-(1-phenylethyl)piperidine-3-carboxamide Openeye Name: N-(1-phenylethyl)-1-[3-(p-tolylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide CAS Name: 1-[3-[(4-methylphenyl)thio]-2-pyrazinyl]-N-(1-phenylethyl)-3-piperidinecarboxamide IUPAC Name: 1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]-N-(1-phenylethyl)piperidine-3-carboxamide Traditional Name: N-(1-phenylethyl)-1-[3-(p-tolylthio)pyrazin-2-yl]nipecotamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4OS/c1-18-10-12-22(13-11-18)31-25-23(26-14-15-27-25)29-16-6-9-21(17-29)24(30)28-19(2)20-7-4-3-5-8-20/h3-5,7-8,10-15,19,21H,6,9,16-17H2,1-2H3,(H,28,30)