2-[[2-(ethylsulfonylamino)-1-(3-methoxy-4-phenylmethoxy-phenyl)ethyl]amino]benzenecarboximidamide

Systemtic Name: 2-[[2-(ethylsulfonylamino)-1-(3-methoxy-4-phenylmethoxy-phenyl)ethyl]amino]benzenecarboximidamide Openeye Name: 2-[[1-(4-benzyloxy-3-methoxy-phenyl)-2-(ethylsulfonylamino)ethyl]amino]benzamidine CAS Name: 2-[[2-(ethylsulfonylamino)-1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]amino]benzenecarboximidamide IUPAC Name: 2-[[2-(ethylsulfonylamino)-1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]amino]benzenecarboximidamide Traditional Name: 2-[[1-(4-benzoxy-3-methoxy-phenyl)-2-(esylamino)ethyl]amino]benzamidine Formula: C25H30N4O4S MolecularWeight: 482.5951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NCC(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)NC3=CC=CC=C3C(=N)N

Isomeric SMILES

CCS(=O)(=O)NCC(C1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)NC3=CC=CC=C3C(=N)N

InChI

InChI=1S/C25H30N4O4S/c1-3-34(30,31)28-16-22(29-21-12-8-7-11-20(21)25(26)27)19-13-14-23(24(15-19)32-2)33-17-18-9-5-4-6-10-18/h4-15,22,28-29H,3,16-17H2,1-2H3,(H3,26,27)