(3S)-N-[1-[4-(4-phenylpiperazin-1-yl)carbonylphenyl]pyrazol-4-yl]oxolane-3-carboxamide

Systemtic Name: (3S)-N-[1-[4-(4-phenylpiperazin-1-yl)carbonylphenyl]pyrazol-4-yl]oxolane-3-carboxamide Openeye Name: (3S)-N-[1-[4-(4-phenylpiperazine-1-carbonyl)phenyl]pyrazol-4-yl]tetrahydrofuran-3-carboxamide CAS Name: (3S)-N-[1-[4-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]-4-pyrazolyl]-3-oxolanecarboxamide IUPAC Name: (3S)-N-[1-[4-(4-phenylpiperazine-1-carbonyl)phenyl]pyrazol-4-yl]oxolane-3-carboxamide Traditional Name: (3S)-N-[1-[4-(4-phenylpiperazine-1-carbonyl)phenyl]pyrazol-4-yl]tetrahydrofuran-3-carboxamide Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(=O)NC2=CN(N=C2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1COC[C@H]1C(=O)NC2=CN(N=C2)C3=CC=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H27N5O3/c31-24(20-10-15-33-18-20)27-21-16-26-30(17-21)23-8-6-19(7-9-23)25(32)29-13-11-28(12-14-29)22-4-2-1-3-5-22/h1-9,16-17,20H,10-15,18H2,(H,27,31)/t20-/m0/s1