N-[1-[4-[4-(2-chlorophenyl)piperazin-1-yl]carbonylphenyl]pyrazol-4-yl]oxane-4-carboxamide

Systemtic Name: N-[1-[4-[4-(2-chlorophenyl)piperazin-1-yl]carbonylphenyl]pyrazol-4-yl]oxane-4-carboxamide Openeye Name: N-[1-[4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]pyrazol-4-yl]tetrahydropyran-4-carboxamide CAS Name: N-[1-[4-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]phenyl]-4-pyrazolyl]-4-oxanecarboxamide IUPAC Name: N-[1-[4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]pyrazol-4-yl]oxane-4-carboxamide Traditional Name: N-[1-[4-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]pyrazol-4-yl]tetrahydropyran-4-carboxamide Formula: C26H28ClN5O3 MolecularWeight: 493.98522

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)NC2=CN(N=C2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5Cl

Isomeric SMILES

C1COCCC1C(=O)NC2=CN(N=C2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5Cl

InChI

InChI=1S/C26H28ClN5O3/c27-23-3-1-2-4-24(23)30-11-13-31(14-12-30)26(34)20-5-7-22(8-6-20)32-18-21(17-28-32)29-25(33)19-9-15-35-16-10-19/h1-8,17-19H,9-16H2,(H,29,33)