1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone

Systemtic Name: 1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone Openeye Name: 1-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone CAS Name: 1-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-2-(1,2-benzoxazol-3-yl)ethanone IUPAC Name: 1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-2-(1,2-benzoxazol-3-yl)ethanone Traditional Name: 1-[4-(benzothiophen-3-ylmethyl)piperazino]-2-indoxazen-3-yl-ethanone Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC3=CC=CC=C32)C(=O)CC4=NOC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CC2=CSC3=CC=CC=C32)C(=O)CC4=NOC5=CC=CC=C54

InChI

InChI=1S/C22H21N3O2S/c26-22(13-19-18-6-1-3-7-20(18)27-23-19)25-11-9-24(10-12-25)14-16-15-28-21-8-4-2-5-17(16)21/h1-8,15H,9-14H2