N-[(1R)-2-(4-butanoylpiperazin-1-yl)-2-oxidanylidene-1-(phenylsulfonyl)ethyl]benzamide

Systemtic Name: N-[(1R)-2-(4-butanoylpiperazin-1-yl)-2-oxidanylidene-1-(phenylsulfonyl)ethyl]benzamide Openeye Name: N-[(1R)-1-(benzenesulfonyl)-2-(4-butanoylpiperazin-1-yl)-2-oxo-ethyl]benzamide CAS Name: N-[(1R)-1-(benzenesulfonyl)-2-oxo-2-[4-(1-oxobutyl)-1-piperazinyl]ethyl]benzamide IUPAC Name: N-[(1R)-1-(benzenesulfonyl)-2-(4-butanoylpiperazin-1-yl)-2-oxoethyl]benzamide Traditional Name: N-[(1R)-1-besyl-2-(4-butyrylpiperazino)-2-keto-ethyl]benzamide Formula: C23H27N3O5S MolecularWeight: 457.54258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C(=O)[C@H](NC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O5S/c1-2-9-20(27)25-14-16-26(17-15-25)23(29)22(24-21(28)18-10-5-3-6-11-18)32(30,31)19-12-7-4-8-13-19/h3-8,10-13,22H,2,9,14-17H2,1H3,(H,24,28)/t22-/m1/s1