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

Systemtic Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)piperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)piperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-(1,2-benzoxazol-3-ylmethyl)piperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[4-(indoxazen-3-ylmethyl)piperazino]-2-(2-thienyl)ethanone Formula: C18H19N3O2S MolecularWeight: 341.42736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NOC3=CC=CC=C32)C(=O)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=NOC3=CC=CC=C32)C(=O)CC4=CC=CS4

InChI

InChI=1S/C18H19N3O2S/c22-18(12-14-4-3-11-24-14)21-9-7-20(8-10-21)13-16-15-5-1-2-6-17(15)23-19-16/h1-6,11H,7-10,12-13H2