N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-(phenylmethyl)-4-propan-2-yl-benzenesulfonamide

Systemtic Name: N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-(phenylmethyl)-4-propan-2-yl-benzenesulfonamide Openeye Name: N-benzyl-4-isopropyl-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: N-[2-oxo-2-(1-piperazinyl)ethyl]-N-(phenylmethyl)-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-benzyl-N-(2-oxo-2-piperazin-1-ylethyl)-4-propan-2-ylbenzenesulfonamide Traditional Name: N-benzyl-4-isopropyl-N-(2-keto-2-piperazino-ethyl)benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCNCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CCNCC3

InChI

InChI=1S/C22H29N3O3S/c1-18(2)20-8-10-21(11-9-20)29(27,28)25(16-19-6-4-3-5-7-19)17-22(26)24-14-12-23-13-15-24/h3-11,18,23H,12-17H2,1-2H3