5-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-3-thiophen-2-yl-1,2-oxazole

Systemtic Name: 5-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-3-thiophen-2-yl-1,2-oxazole Openeye Name: 5-[3-(4-benzylpiperazin-1-yl)propyl]-3-(2-thienyl)isoxazole CAS Name: 5-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-3-thiophen-2-ylisoxazole IUPAC Name: 5-[3-(4-benzylpiperazin-1-yl)propyl]-3-thiophen-2-yl-1,2-oxazole Traditional Name: 5-[3-(4-benzylpiperazino)propyl]-3-(2-thienyl)isoxazole Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC(=NO2)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCC2=CC(=NO2)C3=CC=CS3)CC4=CC=CC=C4

InChI

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