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

Systemtic Name: 1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]-N-(3-morpholin-4-ylpropyl)piperidine-3-carboxamide Openeye Name: N-(3-morpholinopropyl)-1-[3-(p-tolylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide CAS Name: 1-[3-[(4-methylphenyl)thio]-2-pyrazinyl]-N-[3-(4-morpholinyl)propyl]-3-piperidinecarboxamide IUPAC Name: 1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]-N-(3-morpholin-4-ylpropyl)piperidine-3-carboxamide Traditional Name: N-(3-morpholinopropyl)-1-[3-(p-tolylthio)pyrazin-2-yl]nipecotamide Formula: C24H33N5O2S MolecularWeight: 455.61612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C24H33N5O2S/c1-19-5-7-21(8-6-19)32-24-22(25-10-11-27-24)29-13-2-4-20(18-29)23(30)26-9-3-12-28-14-16-31-17-15-28/h5-8,10-11,20H,2-4,9,12-18H2,1H3,(H,26,30)