N'-[2-(3,4-dimethoxyphenyl)ethyl]-N-(phenylsulfonyl)benzenecarboximidamide

Systemtic Name: N'-[2-(3,4-dimethoxyphenyl)ethyl]-N-(phenylsulfonyl)benzenecarboximidamide Openeye Name: N-(benzenesulfonyl)-N'-[2-(3,4-dimethoxyphenyl)ethyl]benzamidine CAS Name: N-(benzenesulfonyl)-N'-[2-(3,4-dimethoxyphenyl)ethyl]benzenecarboximidamide IUPAC Name: N-(benzenesulfonyl)-N'-[2-(3,4-dimethoxyphenyl)ethyl]benzenecarboximidamide Traditional Name: N-besyl-N'-homoveratryl-benzamidine Formula: C23H24N2O4S MolecularWeight: 424.51266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN=C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN=C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C23H24N2O4S/c1-28-21-14-13-18(17-22(21)29-2)15-16-24-23(19-9-5-3-6-10-19)25-30(26,27)20-11-7-4-8-12-20/h3-14,17H,15-16H2,1-2H3,(H,24,25)