2-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-6-phenyl-pyrimidine-4-carboxamide

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperidin-1-yl]-6-phenyl-pyrimidine-4-carboxamide Openeye Name: 2-[4-(4-chlorobenzoyl)-1-piperidyl]-6-phenyl-pyrimidine-4-carboxamide CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperidinyl]-6-phenyl-4-pyrimidinecarboxamide IUPAC Name: 2-[4-(4-chlorobenzoyl)piperidin-1-yl]-6-phenylpyrimidine-4-carboxamide Traditional Name: 2-[4-(4-chlorobenzoyl)piperidino]-6-phenyl-pyrimidine-4-carboxamide Formula: C23H21ClN4O2 MolecularWeight: 420.89144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)Cl)C3=NC(=CC(=N3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)Cl)C3=NC(=CC(=N3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C23H21ClN4O2/c24-18-8-6-16(7-9-18)21(29)17-10-12-28(13-11-17)23-26-19(14-20(27-23)22(25)30)15-4-2-1-3-5-15/h1-9,14,17H,10-13H2,(H2,25,30)