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

Systemtic Name: N-(furan-2-ylmethyl)-1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]piperidine-3-carboxamide Openeye Name: N-(2-furylmethyl)-1-[3-(p-tolylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide CAS Name: N-(2-furanylmethyl)-1-[3-[(4-methylphenyl)thio]-2-pyrazinyl]-3-piperidinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]piperidine-3-carboxamide Traditional Name: N-(2-furfuryl)-1-[3-(p-tolylthio)pyrazin-2-yl]nipecotamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NCC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H24N4O2S/c1-16-6-8-19(9-7-16)29-22-20(23-10-11-24-22)26-12-2-4-17(15-26)21(27)25-14-18-5-3-13-28-18/h3,5-11,13,17H,2,4,12,14-15H2,1H3,(H,25,27)