3-[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl-N,N,4-trimethyl-benzenesulfonamide

Systemtic Name: 3-[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl-N,N,4-trimethyl-benzenesulfonamide Openeye Name: 3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-N,N,4-trimethyl-benzenesulfonamide CAS Name: 3-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]-N,N,4-trimethylbenzenesulfonamide IUPAC Name: 3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-N,N,4-trimethylbenzenesulfonamide Traditional Name: 3-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-N,N,4-trimethyl-benzenesulfonamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-16-8-9-19(29(26,27)22(2)3)15-20(16)21(25)24-12-10-23(11-13-24)17-6-5-7-18(14-17)28-4/h5-9,14-15H,10-13H2,1-4H3