(3S)-3-methyl-5-oxidanylidene-5-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]pentanoate

Systemtic Name: (3S)-3-methyl-5-oxidanylidene-5-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]pentanoate Openeye Name: (3S)-5-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-3-methyl-5-oxo-pentanoate CAS Name: (3S)-3-methyl-5-oxo-5-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]pentanoate IUPAC Name: (3S)-3-methyl-5-oxo-5-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]pentanoate Traditional Name: (3S)-5-keto-3-methyl-5-(4-p-cumenylsulfonylpiperazino)valerate Formula: C19H27N2O5S- MolecularWeight: 395.49308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC(C)CC(=O)[O-]

Isomeric SMILES

C[C@@H](CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)C)CC(=O)[O-]

InChI

InChI=1S/C19H28N2O5S/c1-14(2)16-4-6-17(7-5-16)27(25,26)21-10-8-20(9-11-21)18(22)12-15(3)13-19(23)24/h4-7,14-15H,8-13H2,1-3H3,(H,23,24)/p-1/t15-/m0/s1