2-[4-(3-aminophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[4-(3-aminophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[4-(3-aminophenyl)sulfonyl-3,5-dimethyl-piperazin-1-yl]-N-(o-tolyl)acetamide CAS Name: 2-[4-(3-aminophenyl)sulfonyl-3,5-dimethyl-1-piperazinyl]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[4-(3-aminophenyl)sulfonyl-3,5-dimethylpiperazin-1-yl]-N-(2-methylphenyl)acetamide Traditional Name: 2-[4-(3-aminophenyl)sulfonyl-3,5-dimethyl-piperazino]-N-(o-tolyl)acetamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1S(=O)(=O)C2=CC=CC(=C2)N)C)CC(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1CN(CC(N1S(=O)(=O)C2=CC=CC(=C2)N)C)CC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C21H28N4O3S/c1-15-7-4-5-10-20(15)23-21(26)14-24-12-16(2)25(17(3)13-24)29(27,28)19-9-6-8-18(22)11-19/h4-11,16-17H,12-14,22H2,1-3H3,(H,23,26)