N-(2-ethoxyphenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(2-ethoxyphenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide Openeye Name: N-(2-ethoxyphenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide CAS Name: N-(2-ethoxyphenyl)-1-[3-(phenylthio)-2-pyrazinyl]-4-piperidinecarboxamide IUPAC Name: N-(2-ethoxyphenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide Traditional Name: N-o-phenetyl-1-[3-(phenylthio)pyrazin-2-yl]isonipecotamide Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2CCN(CC2)C3=NC=CN=C3SC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2CCN(CC2)C3=NC=CN=C3SC4=CC=CC=C4

InChI

InChI=1S/C24H26N4O2S/c1-2-30-21-11-7-6-10-20(21)27-23(29)18-12-16-28(17-13-18)22-24(26-15-14-25-22)31-19-8-4-3-5-9-19/h3-11,14-15,18H,2,12-13,16-17H2,1H3,(H,27,29)