N-(oxan-2-yloxy)-2-[4-[(4-phenylphenyl)carbamoyl]piperazin-1-yl]pyrimidine-5-carboxamide

Systemtic Name: N-(oxan-2-yloxy)-2-[4-[(4-phenylphenyl)carbamoyl]piperazin-1-yl]pyrimidine-5-carboxamide Openeye Name: 2-[4-[(4-phenylphenyl)carbamoyl]piperazin-1-yl]-N-tetrahydropyran-2-yloxy-pyrimidine-5-carboxamide CAS Name: N-(2-oxanyloxy)-2-[4-[oxo-(4-phenylanilino)methyl]-1-piperazinyl]-5-pyrimidinecarboxamide IUPAC Name: N-(oxan-2-yloxy)-2-[4-[(4-phenylphenyl)carbamoyl]piperazin-1-yl]pyrimidine-5-carboxamide Traditional Name: 2-[4-[(4-phenylphenyl)carbamoyl]piperazino]-N-tetrahydropyran-2-yloxy-pyrimidine-5-carboxamide Formula: C27H30N6O4 MolecularWeight: 502.5649

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)ONC(=O)C2=CN=C(N=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCOC(C1)ONC(=O)C2=CN=C(N=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H30N6O4/c34-25(31-37-24-8-4-5-17-36-24)22-18-28-26(29-19-22)32-13-15-33(16-14-32)27(35)30-23-11-9-21(10-12-23)20-6-2-1-3-7-20/h1-3,6-7,9-12,18-19,24H,4-5,8,13-17H2,(H,30,35)(H,31,34)