4-methoxy-3-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-methoxy-3-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-methoxy-3-[4-(o-tolylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-methoxy-3-[[4-[(2-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: 4-methoxy-3-[4-[(2-methylphenyl)methyl]piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-methoxy-3-[4-(2-methylbenzyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N)OC

InChI

InChI=1S/C20H25N3O4S/c1-15-5-3-4-6-16(15)14-22-9-11-23(12-10-22)20(24)18-13-17(28(21,25)26)7-8-19(18)27-2/h3-8,13H,9-12,14H2,1-2H3,(H2,21,25,26)