4-[ethyl-[(3-methoxy-4-phenylmethoxy-phenyl)-[2-(methylsulfonylamino)propylsulfonyl]amino]amino]benzenecarboximidamide

Systemtic Name: 4-[ethyl-[(3-methoxy-4-phenylmethoxy-phenyl)-[2-(methylsulfonylamino)propylsulfonyl]amino]amino]benzenecarboximidamide Openeye Name: 4-[[4-benzyloxy-N-[2-(methanesulfonamido)propylsulfonyl]-3-methoxy-anilino]-ethyl-amino]benzamidine CAS Name: 4-[ethyl-[N-[2-(methanesulfonamido)propylsulfonyl]-3-methoxy-4-phenylmethoxyanilino]amino]benzenecarboximidamide IUPAC Name: 4-[ethyl-[N-[2-(methanesulfonamido)propylsulfonyl]-3-methoxy-4-phenylmethoxyanilino]amino]benzenecarboximidamide Traditional Name: 4-[[4-benzoxy-N-[2-(methanesulfonamido)propylsulfonyl]-3-methoxy-anilino]-ethyl-amino]benzamidine Formula: C27H35N5O6S2 MolecularWeight: 589.7267

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=N)N)N(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)S(=O)(=O)CC(C)NS(=O)(=O)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=N)N)N(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)S(=O)(=O)CC(C)NS(=O)(=O)C

InChI

InChI=1S/C27H35N5O6S2/c1-5-31(23-13-11-22(12-14-23)27(28)29)32(40(35,36)19-20(2)30-39(4,33)34)24-15-16-25(26(17-24)37-3)38-18-21-9-7-6-8-10-21/h6-17,20,30H,5,18-19H2,1-4H3,(H3,28,29)