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

Systemtic Name: 1-[3-(3-methylphenyl)sulfanylpyrazin-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide Openeye Name: N-(2-morpholinoethyl)-1-[3-(m-tolylsulfanyl)pyrazin-2-yl]piperidine-4-carboxamide CAS Name: 1-[3-[(3-methylphenyl)thio]-2-pyrazinyl]-N-[2-(4-morpholinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-(3-methylphenyl)sulfanylpyrazin-2-yl]-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide Traditional Name: N-(2-morpholinoethyl)-1-[3-(m-tolylthio)pyrazin-2-yl]isonipecotamide Formula: C23H31N5O2S MolecularWeight: 441.58954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=NC=CN=C2N3CCC(CC3)C(=O)NCCN4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)SC2=NC=CN=C2N3CCC(CC3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C23H31N5O2S/c1-18-3-2-4-20(17-18)31-23-21(24-7-8-26-23)28-10-5-19(6-11-28)22(29)25-9-12-27-13-15-30-16-14-27/h2-4,7-8,17,19H,5-6,9-16H2,1H3,(H,25,29)