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

Systemtic Name: 5-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-3-thiophen-2-yl-1,2-oxazole Openeye Name: 5-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-(2-thienyl)isoxazole CAS Name: 5-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-3-thiophen-2-ylisoxazole IUPAC Name: 5-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-thiophen-2-yl-1,2-oxazole Traditional Name: 5-[3-(4-benzhydrylpiperazino)propyl]-3-(2-thienyl)isoxazole Formula: C27H29N3OS MolecularWeight: 443.60366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC(=NO2)C3=CC=CS3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCC2=CC(=NO2)C3=CC=CS3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N3OS/c1-3-9-22(10-4-1)27(23-11-5-2-6-12-23)30-18-16-29(17-19-30)15-7-13-24-21-25(28-31-24)26-14-8-20-32-26/h1-6,8-12,14,20-21,27H,7,13,15-19H2