N-chloranyl-N-[4-(1-ethylpiperazin-2-yl)phenyl]-3-(2-methanoylphenyl)propane-1-sulfonamide

Systemtic Name: N-chloranyl-N-[4-(1-ethylpiperazin-2-yl)phenyl]-3-(2-methanoylphenyl)propane-1-sulfonamide Openeye Name: N-chloro-N-[4-(1-ethylpiperazin-2-yl)phenyl]-3-(2-formylphenyl)propane-1-sulfonamide CAS Name: N-chloro-N-[4-(1-ethyl-2-piperazinyl)phenyl]-3-(2-formylphenyl)-1-propanesulfonamide IUPAC Name: N-chloro-N-[4-(1-ethylpiperazin-2-yl)phenyl]-3-(2-formylphenyl)propane-1-sulfonamide Traditional Name: N-chloro-N-[4-(1-ethylpiperazin-2-yl)phenyl]-3-(2-formylphenyl)propane-1-sulfonamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCNCC1C2=CC=C(C=C2)N(S(=O)(=O)CCCC3=CC=CC=C3C=O)Cl

Isomeric SMILES

CCN1CCNCC1C2=CC=C(C=C2)N(S(=O)(=O)CCCC3=CC=CC=C3C=O)Cl

InChI

InChI=1S/C22H28ClN3O3S/c1-2-25-14-13-24-16-22(25)19-9-11-21(12-10-19)26(23)30(28,29)15-5-8-18-6-3-4-7-20(18)17-27/h3-4,6-7,9-12,17,22,24H,2,5,8,13-16H2,1H3