N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-1-pyrazin-2-yl-piperidine-3-carboxamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-1-(2-pyrazinyl)-3-piperidinecarboxamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-1-pyrazin-2-ylpiperidine-3-carboxamide Traditional Name: N-[3-(cyclopropanecarbonylamino)benzyl]-1-pyrazin-2-yl-nipecotamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CN=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

Isomeric SMILES

C1CC(CN(C1)C2=NC=CN=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C21H25N5O2/c27-20(17-4-2-10-26(14-17)19-13-22-8-9-23-19)24-12-15-3-1-5-18(11-15)25-21(28)16-6-7-16/h1,3,5,8-9,11,13,16-17H,2,4,6-7,10,12,14H2,(H,24,27)(H,25,28)