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

Systemtic Name: 5-[4-[4-(phenylmethyl)piperazin-1-yl]butyl]-3-thiophen-2-yl-1,2-oxazole Openeye Name: 5-[4-(4-benzylpiperazin-1-yl)butyl]-3-(2-thienyl)isoxazole CAS Name: 5-[4-[4-(phenylmethyl)-1-piperazinyl]butyl]-3-thiophen-2-ylisoxazole IUPAC Name: 5-[4-(4-benzylpiperazin-1-yl)butyl]-3-thiophen-2-yl-1,2-oxazole Traditional Name: 5-[4-(4-benzylpiperazino)butyl]-3-(2-thienyl)isoxazole Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3OS/c1-2-7-19(8-3-1)18-25-14-12-24(13-15-25)11-5-4-9-20-17-21(23-26-20)22-10-6-16-27-22/h1-3,6-8,10,16-17H,4-5,9,11-15,18H2