2-[(2,4-dimethylphenyl)amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(2,4-dimethylphenyl)amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2,4-dimethylanilino)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(2,4-dimethylanilino)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2,4-dimethylanilino)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(2,4-dimethylanilino)ethanone Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O3S/c1-16-8-9-19(17(2)14-16)21-15-20(24)22-10-12-23(13-11-22)27(25,26)18-6-4-3-5-7-18/h3-9,14,21H,10-13,15H2,1-2H3