5-[4-(4-phenylpiperazin-1-yl)butyl]-3-thiophen-2-yl-1,2-oxazole hydrochloride

Systemtic Name: 5-[4-(4-phenylpiperazin-1-yl)butyl]-3-thiophen-2-yl-1,2-oxazole hydrochloride Openeye Name: 5-[4-(4-phenylpiperazin-1-yl)butyl]-3-(2-thienyl)isoxazole hydrochloride CAS Name: 5-[4-(4-phenyl-1-piperazinyl)butyl]-3-thiophen-2-ylisoxazole hydrochloride IUPAC Name: 5-[4-(4-phenylpiperazin-1-yl)butyl]-3-thiophen-2-yl-1,2-oxazole hydrochloride Traditional Name: 5-[4-(4-phenylpiperazino)butyl]-3-(2-thienyl)isoxazole hydrochloride Formula: C21H26ClN3OS MolecularWeight: 403.96864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC=CS3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC=CS3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C21H25N3OS.ClH/c1-2-7-18(8-3-1)24-14-12-23(13-15-24)11-5-4-9-19-17-20(22-25-19)21-10-6-16-26-21;/h1-3,6-8,10,16-17H,4-5,9,11-15H2;1H