N-ethyl-N-[4-(4-ethylpiperazin-1-yl)carbonylphenyl]-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-ethyl-N-[4-(4-ethylpiperazin-1-yl)carbonylphenyl]-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-ethyl-N-[4-(4-ethylpiperazine-1-carbonyl)phenyl]-4-methylsulfanyl-benzenesulfonamide CAS Name: N-ethyl-N-[4-[(4-ethyl-1-piperazinyl)-oxomethyl]phenyl]-4-(methylthio)benzenesulfonamide IUPAC Name: N-ethyl-N-[4-(4-ethylpiperazine-1-carbonyl)phenyl]-4-methylsulfanylbenzenesulfonamide Traditional Name: N-ethyl-N-[4-(4-ethylpiperazine-1-carbonyl)phenyl]-4-(methylthio)benzenesulfonamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC=C(C=C2)N(CC)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H29N3O3S2/c1-4-23-14-16-24(17-15-23)22(26)18-6-8-19(9-7-18)25(5-2)30(27,28)21-12-10-20(29-3)11-13-21/h6-13H,4-5,14-17H2,1-3H3