3-azanyl-5-methylsulfanyl-1-phenyl-pentan-2-one

Systemtic Name: 3-azanyl-5-methylsulfanyl-1-phenyl-pentan-2-one Openeye Name: 3-amino-5-methylsulfanyl-1-phenyl-pentan-2-one CAS Name: 3-amino-5-(methylthio)-1-phenyl-2-pentanone IUPAC Name: 3-amino-5-methylsulfanyl-1-phenylpentan-2-one Traditional Name: 3-amino-5-(methylthio)-1-phenyl-pentan-2-one Formula: C12H17NOS MolecularWeight: 223.33448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)CC1=CC=CC=C1)N

Isomeric SMILES

CSCCC(C(=O)CC1=CC=CC=C1)N

InChI

InChI=1S/C12H17NOS/c1-15-8-7-11(13)12(14)9-10-5-3-2-4-6-10/h2-6,11H,7-9,13H2,1H3