N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-1-pyrazin-2-yl-nipecotamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCCN(C3)C4=NC=CN=C4

InChI

InChI=1S/C23H26N4OS/c1-2-17-7-9-18(10-8-17)22(20-6-4-14-29-20)26-23(28)19-5-3-13-27(16-19)21-15-24-11-12-25-21/h4,6-12,14-15,19,22H,2-3,5,13,16H2,1H3,(H,26,28)