N-(4-methoxyphenyl)-3-(3-oxidanylidenepiperazin-1-yl)carbonyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-(3-oxidanylidenepiperazin-1-yl)carbonyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-(4-methoxyphenyl)-3-(3-oxopiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-3-[oxo-(3-oxo-1-piperazinyl)methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-(4-methoxyphenyl)-3-(3-oxopiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-benzyl-3-(3-ketopiperazine-1-carbonyl)-N-(4-methoxyphenyl)benzenesulfonamide Formula: C25H25N3O5S MolecularWeight: 479.5481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CCNC(=O)C4

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CCNC(=O)C4

InChI

InChI=1S/C25H25N3O5S/c1-33-22-12-10-21(11-13-22)28(17-19-6-3-2-4-7-19)34(31,32)23-9-5-8-20(16-23)25(30)27-15-14-26-24(29)18-27/h2-13,16H,14-15,17-18H2,1H3,(H,26,29)