1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]-2-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]-2-phenylsulfanyl-propan-1-one Openeye Name: 1-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazin-1-yl]-2-phenylsulfanyl-propan-1-one CAS Name: 1-[4-[(3,5-dimethyl-4-isoxazolyl)methyl]-1-piperazinyl]-2-(phenylthio)-1-propanone IUPAC Name: 1-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]-2-phenylsulfanylpropan-1-one Traditional Name: 1-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazino]-2-(phenylthio)propan-1-one Formula: C19H25N3O2S MolecularWeight: 359.4857

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)C(C)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)C(C)SC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O2S/c1-14-18(15(2)24-20-14)13-21-9-11-22(12-10-21)19(23)16(3)25-17-7-5-4-6-8-17/h4-8,16H,9-13H2,1-3H3