[[4-[3-(3-azanylpyrazin-2-yl)-3-oxidanylidene-propyl]-4-phenyl-piperidin-1-yl]-(methylamino)methyl]cyanamide

Systemtic Name: [[4-[3-(3-azanylpyrazin-2-yl)-3-oxidanylidene-propyl]-4-phenyl-piperidin-1-yl]-(methylamino)methyl]cyanamide Openeye Name: [[4-[3-(3-aminopyrazin-2-yl)-3-oxo-propyl]-4-phenyl-1-piperidyl]-(methylamino)methyl]cyanamide CAS Name: [[4-[3-(3-amino-2-pyrazinyl)-3-oxopropyl]-4-phenyl-1-piperidinyl]-(methylamino)methyl]cyanamide IUPAC Name: [[4-[3-(3-aminopyrazin-2-yl)-3-oxopropyl]-4-phenylpiperidin-1-yl]-(methylamino)methyl]cyanamide Traditional Name: [[4-[3-(3-aminopyrazin-2-yl)-3-keto-propyl]-4-phenyl-piperidino]-(methylamino)methyl]cyanamide Formula: C21H27N7O MolecularWeight: 393.48538

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Descriptors Computed from Structure

Canonical SMILES:

CNC(NC#N)N1CCC(CC1)(CCC(=O)C2=NC=CN=C2N)C3=CC=CC=C3

Isomeric SMILES

CNC(NC#N)N1CCC(CC1)(CCC(=O)C2=NC=CN=C2N)C3=CC=CC=C3

InChI

InChI=1S/C21H27N7O/c1-24-20(27-15-22)28-13-9-21(10-14-28,16-5-3-2-4-6-16)8-7-17(29)18-19(23)26-12-11-25-18/h2-6,11-12,20,24,27H,7-10,13-14H2,1H3,(H2,23,26)