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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N(C)C(C)C)Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N(C)C(C)C)Cl

InChI

InChI=1S/C22H28ClN3O3S/c1-16(2)24(4)30(28,29)19-8-9-21(23)20(15-19)22(27)26-12-10-25(11-13-26)18-7-5-6-17(3)14-18/h5-9,14-16H,10-13H2,1-4H3