N-[2-chloranyl-5-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)phenyl]ethanesulfonamide

Systemtic Name: N-[2-chloranyl-5-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)phenyl]ethanesulfonamide Openeye Name: N-[2-chloro-5-(4-ethylpiperazin-1-yl)-3-(o-tolyl)phenyl]ethanesulfonamide CAS Name: N-[2-chloro-5-(4-ethyl-1-piperazinyl)-3-(2-methylphenyl)phenyl]ethanesulfonamide IUPAC Name: N-[2-chloro-5-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)phenyl]ethanesulfonamide Traditional Name: N-[2-chloro-5-(4-ethylpiperazino)-3-(o-tolyl)phenyl]ethanesulfonamide Formula: C21H28ClN3O2S MolecularWeight: 421.98392

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)NS(=O)(=O)CC

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)NS(=O)(=O)CC

InChI

InChI=1S/C21H28ClN3O2S/c1-4-24-10-12-25(13-11-24)17-14-19(18-9-7-6-8-16(18)3)21(22)20(15-17)23-28(26,27)5-2/h6-9,14-15,23H,4-5,10-13H2,1-3H3