4-chloranyl-N-methyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-methyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-4-chloro-N-isopropyl-N-methyl-benzenesulfonamide CAS Name: 4-chloro-N-methyl-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-4-chloro-N-methyl-N-propan-2-ylbenzenesulfonamide Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-4-chloro-N-isopropyl-N-methyl-benzenesulfonamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)N(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28ClN3O3S/c1-17(2)24(3)30(28,29)19-9-10-21(23)20(15-19)22(27)26-13-11-25(12-14-26)16-18-7-5-4-6-8-18/h4-10,15,17H,11-14,16H2,1-3H3