(2S)-1-piperazin-1-yl-2-(2,4,6-trimethylphenyl)sulfanyl-propan-1-one

Systemtic Name: (2S)-1-piperazin-1-yl-2-(2,4,6-trimethylphenyl)sulfanyl-propan-1-one Openeye Name: (2S)-1-piperazin-1-yl-2-(2,4,6-trimethylphenyl)sulfanyl-propan-1-one CAS Name: (2S)-1-(1-piperazinyl)-2-[(2,4,6-trimethylphenyl)thio]-1-propanone IUPAC Name: (2S)-1-piperazin-1-yl-2-(2,4,6-trimethylphenyl)sulfanylpropan-1-one Traditional Name: (2S)-2-(mesitylthio)-1-piperazino-propan-1-one Formula: C16H24N2OS MolecularWeight: 292.43956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SC(C)C(=O)N2CCNCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S[C@@H](C)C(=O)N2CCNCC2)C

InChI

InChI=1S/C16H24N2OS/c1-11-9-12(2)15(13(3)10-11)20-14(4)16(19)18-7-5-17-6-8-18/h9-10,14,17H,5-8H2,1-4H3/t14-/m0/s1