N-[3-oxidanylidene-3-[[1-(phenylmethyl)piperidin-4-yl]amino]propyl]-N-phenethyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-[[1-(phenylmethyl)piperidin-4-yl]amino]propyl]-N-phenethyl-pyrazine-2-carboxamide Openeye Name: N-[3-[(1-benzyl-4-piperidyl)amino]-3-oxo-propyl]-N-phenethyl-pyrazine-2-carboxamide CAS Name: N-[3-oxo-3-[[1-(phenylmethyl)-4-piperidinyl]amino]propyl]-N-phenethyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[(1-benzylpiperidin-4-yl)amino]-3-oxopropyl]-N-phenethylpyrazine-2-carboxamide Traditional Name: N-[3-[(1-benzyl-4-piperidyl)amino]-3-keto-propyl]-N-phenethyl-pyrazinamide Formula: C28H33N5O2 MolecularWeight: 471.59392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCN(CCC2=CC=CC=C2)C(=O)C3=NC=CN=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)CCN(CCC2=CC=CC=C2)C(=O)C3=NC=CN=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H33N5O2/c34-27(31-25-12-17-32(18-13-25)22-24-9-5-2-6-10-24)14-20-33(19-11-23-7-3-1-4-8-23)28(35)26-21-29-15-16-30-26/h1-10,15-16,21,25H,11-14,17-20,22H2,(H,31,34)