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

Systemtic Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]-2-naphthalen-2-ylsulfanyl-ethanone Openeye Name: 1-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-1-yl]-2-(2-naphthylsulfanyl)ethanone CAS Name: 1-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinyl]-2-(2-naphthalenylthio)ethanone IUPAC Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]-2-naphthalen-2-ylsulfanylethanone Traditional Name: 1-[4-[(5-methylisoxazol-3-yl)methyl]piperazino]-2-(2-naphthylthio)ethanone Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCN(CC2)C(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=NO1)CN2CCN(CC2)C(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H23N3O2S/c1-16-12-19(22-26-16)14-23-8-10-24(11-9-23)21(25)15-27-20-7-6-17-4-2-3-5-18(17)13-20/h2-7,12-13H,8-11,14-15H2,1H3