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

Systemtic Name: N-(2-methoxyphenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide Openeye Name: N-(2-methoxyphenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide CAS Name: N-(2-methoxyphenyl)-1-[3-(phenylthio)-2-pyrazinyl]-4-piperidinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide Traditional Name: N-(2-methoxyphenyl)-1-[3-(phenylthio)pyrazin-2-yl]isonipecotamide Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C3=NC=CN=C3SC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C3=NC=CN=C3SC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O2S/c1-29-20-10-6-5-9-19(20)26-22(28)17-11-15-27(16-12-17)21-23(25-14-13-24-21)30-18-7-3-2-4-8-18/h2-10,13-14,17H,11-12,15-16H2,1H3,(H,26,28)