N-[(2,5-dimethoxyphenyl)methyl]-1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]piperidine-3-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]piperidine-3-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-1-[3-(p-tolylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-1-[3-[(4-methylphenyl)thio]-2-pyrazinyl]-3-piperidinecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-1-[3-(4-methylphenyl)sulfanylpyrazin-2-yl]piperidine-3-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-1-[3-(p-tolylthio)pyrazin-2-yl]nipecotamide Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NCC4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=CN=C2N3CCCC(C3)C(=O)NCC4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C26H30N4O3S/c1-18-6-9-22(10-7-18)34-26-24(27-12-13-28-26)30-14-4-5-19(17-30)25(31)29-16-20-15-21(32-2)8-11-23(20)33-3/h6-13,15,19H,4-5,14,16-17H2,1-3H3,(H,29,31)