2-[4-(3-phenylpropyl)piperidin-1-yl]-N-[4-[(pyrimidin-2-ylamino)methyl]phenyl]benzamide

Systemtic Name: 2-[4-(3-phenylpropyl)piperidin-1-yl]-N-[4-[(pyrimidin-2-ylamino)methyl]phenyl]benzamide Openeye Name: 2-[4-(3-phenylpropyl)-1-piperidyl]-N-[4-[(pyrimidin-2-ylamino)methyl]phenyl]benzamide CAS Name: 2-[4-(3-phenylpropyl)-1-piperidinyl]-N-[4-[(2-pyrimidinylamino)methyl]phenyl]benzamide IUPAC Name: 2-[4-(3-phenylpropyl)piperidin-1-yl]-N-[4-[(pyrimidin-2-ylamino)methyl]phenyl]benzamide Traditional Name: 2-[4-(3-phenylpropyl)piperidino]-N-[4-[(2-pyrimidylamino)methyl]phenyl]benzamide Formula: C32H35N5O MolecularWeight: 505.6532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCCC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)CNC5=NC=CC=N5

Isomeric SMILES

C1CN(CCC1CCCC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)CNC5=NC=CC=N5

InChI

InChI=1S/C32H35N5O/c38-31(36-28-16-14-27(15-17-28)24-35-32-33-20-7-21-34-32)29-12-4-5-13-30(29)37-22-18-26(19-23-37)11-6-10-25-8-2-1-3-9-25/h1-5,7-9,12-17,20-21,26H,6,10-11,18-19,22-24H2,(H,36,38)(H,33,34,35)