3-(4-tert-butylphenyl)-5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1,2-oxazole

Systemtic Name: 3-(4-tert-butylphenyl)-5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1,2-oxazole Openeye Name: 3-(4-tert-butylphenyl)-5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]isoxazole CAS Name: 3-(4-tert-butylphenyl)-5-[4-[3-(4-methyl-1-piperazinyl)propoxy]phenyl]isoxazole IUPAC Name: 3-(4-tert-butylphenyl)-5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1,2-oxazole Traditional Name: 3-(4-tert-butylphenyl)-5-[4-[3-(4-methylpiperazino)propoxy]phenyl]isoxazole Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=C2)C3=CC=C(C=C3)OCCCN4CCN(CC4)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NOC(=C2)C3=CC=C(C=C3)OCCCN4CCN(CC4)C

InChI

InChI=1S/C27H35N3O2/c1-27(2,3)23-10-6-21(7-11-23)25-20-26(32-28-25)22-8-12-24(13-9-22)31-19-5-14-30-17-15-29(4)16-18-30/h6-13,20H,5,14-19H2,1-4H3