(2S)-2-(4-tert-butylphenyl)sulfanyl-1-piperazin-1-yl-propan-1-one

Systemtic Name: (2S)-2-(4-tert-butylphenyl)sulfanyl-1-piperazin-1-yl-propan-1-one Openeye Name: (2S)-2-(4-tert-butylphenyl)sulfanyl-1-piperazin-1-yl-propan-1-one CAS Name: (2S)-2-[(4-tert-butylphenyl)thio]-1-(1-piperazinyl)-1-propanone IUPAC Name: (2S)-2-(4-tert-butylphenyl)sulfanyl-1-piperazin-1-ylpropan-1-one Traditional Name: (2S)-2-[(4-tert-butylphenyl)thio]-1-piperazino-propan-1-one Formula: C17H26N2OS MolecularWeight: 306.46614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNCC1)SC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)N1CCNCC1)SC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C17H26N2OS/c1-13(16(20)19-11-9-18-10-12-19)21-15-7-5-14(6-8-15)17(2,3)4/h5-8,13,18H,9-12H2,1-4H3/t13-/m0/s1