N-[3-cyano-4-[4-[1,3-oxazol-2-yl(phenyl)methyl]piperazin-1-yl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-cyano-4-[4-[1,3-oxazol-2-yl(phenyl)methyl]piperazin-1-yl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-cyano-4-[4-[oxazol-2-yl(phenyl)methyl]piperazin-1-yl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-cyano-4-[4-[2-oxazolyl(phenyl)methyl]-1-piperazinyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-cyano-4-[4-[1,3-oxazol-2-yl(phenyl)methyl]piperazin-1-yl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-cyano-4-[4-[oxazol-2-yl(phenyl)methyl]piperazino]phenyl]cyclopropanecarboxamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=NC=CO5)C#N

Isomeric SMILES

C1CC1C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=NC=CO5)C#N

InChI

InChI=1S/C25H25N5O2/c26-17-20-16-21(28-24(31)19-6-7-19)8-9-22(20)29-11-13-30(14-12-29)23(25-27-10-15-32-25)18-4-2-1-3-5-18/h1-5,8-10,15-16,19,23H,6-7,11-14H2,(H,28,31)