N4-(1,3-benzodioxol-5-ylmethyl)-N1-(phenylmethyl)-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-N1-(phenylmethyl)-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-N1-benzyl-N4-(2-thienylmethyl)benzene-1,4-disulfonamide CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-N1-(phenylmethyl)-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-1-N-benzyl-4-N-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide Traditional Name: N-benzyl-N'-piperonyl-N'-(2-thenyl)benzene-1,4-disulfonamide Formula: C26H24N2O6S3 MolecularWeight: 556.67356

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(CC3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(CC3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C26H24N2O6S3/c29-36(30,27-16-20-5-2-1-3-6-20)23-9-11-24(12-10-23)37(31,32)28(18-22-7-4-14-35-22)17-21-8-13-25-26(15-21)34-19-33-25/h1-15,27H,16-19H2