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

Systemtic Name: 4-[[1-(3-methoxy-4-phenylmethoxy-phenyl)-2-[(phenylmethyl)sulfonylamino]ethyl]amino]benzenecarboximidamide Openeye Name: 4-[[1-(4-benzyloxy-3-methoxy-phenyl)-2-(benzylsulfonylamino)ethyl]amino]benzamidine CAS Name: 4-[[1-(3-methoxy-4-phenylmethoxyphenyl)-2-[(phenylmethyl)sulfonylamino]ethyl]amino]benzenecarboximidamide IUPAC Name: 4-[[2-(benzylsulfonylamino)-1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]amino]benzenecarboximidamide Traditional Name: 4-[[1-(4-benzoxy-3-methoxy-phenyl)-2-(benzylsulfonylamino)ethyl]amino]benzamidine Formula: C30H32N4O4S MolecularWeight: 544.66448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(CNS(=O)(=O)CC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(CNS(=O)(=O)CC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N)OCC4=CC=CC=C4

InChI

InChI=1S/C30H32N4O4S/c1-37-29-18-25(14-17-28(29)38-20-22-8-4-2-5-9-22)27(34-26-15-12-24(13-16-26)30(31)32)19-33-39(35,36)21-23-10-6-3-7-11-23/h2-18,27,33-34H,19-21H2,1H3,(H3,31,32)