N4-[(2-chlorophenyl)methyl]-N4-cyclopropyl-N1-ethyl-N1-(phenylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N4-[(2-chlorophenyl)methyl]-N4-cyclopropyl-N1-ethyl-N1-(phenylmethyl)benzene-1,4-disulfonamide Openeye Name: N1-benzyl-N4-[(2-chlorophenyl)methyl]-N4-cyclopropyl-N1-ethyl-benzene-1,4-disulfonamide CAS Name: N4-[(2-chlorophenyl)methyl]-N4-cyclopropyl-N1-ethyl-N1-(phenylmethyl)benzene-1,4-disulfonamide IUPAC Name: 1-N-benzyl-4-N-[(2-chlorophenyl)methyl]-4-N-cyclopropyl-1-N-ethylbenzene-1,4-disulfonamide Traditional Name: N-benzyl-N'-(2-chlorobenzyl)-N'-cyclopropyl-N-ethyl-benzene-1,4-disulfonamide Formula: C25H27ClN2O4S2 MolecularWeight: 519.07588

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3Cl)C4CC4

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3Cl)C4CC4

InChI

InChI=1S/C25H27ClN2O4S2/c1-2-27(18-20-8-4-3-5-9-20)33(29,30)23-14-16-24(17-15-23)34(31,32)28(22-12-13-22)19-21-10-6-7-11-25(21)26/h3-11,14-17,22H,2,12-13,18-19H2,1H3