2-[(2-chlorophenyl)methylamino]-N-[3-(3-hydroxyphenyl)-3-oxidanyl-propyl]-4-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[(2-chlorophenyl)methylamino]-N-[3-(3-hydroxyphenyl)-3-oxidanyl-propyl]-4-phenyl-pyrimidine-5-carboxamide Openeye Name: 2-[(2-chlorophenyl)methylamino]-N-[3-hydroxy-3-(3-hydroxyphenyl)propyl]-4-phenyl-pyrimidine-5-carboxamide CAS Name: 2-[(2-chlorophenyl)methylamino]-N-[3-hydroxy-3-(3-hydroxyphenyl)propyl]-4-phenyl-5-pyrimidinecarboxamide IUPAC Name: 2-[(2-chlorophenyl)methylamino]-N-[3-hydroxy-3-(3-hydroxyphenyl)propyl]-4-phenylpyrimidine-5-carboxamide Traditional Name: 2-[(2-chlorobenzyl)amino]-N-[3-hydroxy-3-(3-hydroxyphenyl)propyl]-4-phenyl-pyrimidine-5-carboxamide Formula: C27H25ClN4O3 MolecularWeight: 488.9654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC=C2C(=O)NCCC(C3=CC(=CC=C3)O)O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC=C2C(=O)NCCC(C3=CC(=CC=C3)O)O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C27H25ClN4O3/c28-23-12-5-4-9-20(23)16-30-27-31-17-22(25(32-27)18-7-2-1-3-8-18)26(35)29-14-13-24(34)19-10-6-11-21(33)15-19/h1-12,15,17,24,33-34H,13-14,16H2,(H,29,35)(H,30,31,32)