2-methoxy-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 2-methoxy-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide Openeye Name: 5-(4-benzylpiperazine-1-carbonyl)-N-isopropyl-2-methoxy-benzenesulfonamide CAS Name: 2-methoxy-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 5-(4-benzylpiperazine-1-carbonyl)-2-methoxy-N-propan-2-ylbenzenesulfonamide Traditional Name: 5-(4-benzylpiperazine-1-carbonyl)-N-isopropyl-2-methoxy-benzenesulfonamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)NS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C22H29N3O4S/c1-17(2)23-30(27,28)21-15-19(9-10-20(21)29-3)22(26)25-13-11-24(12-14-25)16-18-7-5-4-6-8-18/h4-10,15,17,23H,11-14,16H2,1-3H3