1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-[(3,5-dimethyl-4-isoxazolyl)methyl]-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazino]-2-(2-thienyl)ethanone Formula: C16H21N3O2S MolecularWeight: 319.42184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)CC3=CC=CS3

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)CC3=CC=CS3

InChI

InChI=1S/C16H21N3O2S/c1-12-15(13(2)21-17-12)11-18-5-7-19(8-6-18)16(20)10-14-4-3-9-22-14/h3-4,9H,5-8,10-11H2,1-2H3