2-[(4-carbamimidoylphenyl)amino]-2-[5-methoxy-2-(methylsulfonylamino)-4-phenylmethoxy-phenyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[5-methoxy-2-(methylsulfonylamino)-4-phenylmethoxy-phenyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-benzyloxy-2-(methanesulfonamido)-5-methoxy-phenyl]-2-(4-carbamimidoylanilino)acetamide CAS Name: 2-(4-carbamimidoylanilino)-2-[2-(methanesulfonamido)-5-methoxy-4-phenylmethoxyphenyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(4-carbamimidoylanilino)-2-[2-(methanesulfonamido)-5-methoxy-4-phenylmethoxyphenyl]acetamide Traditional Name: 2-(4-amidinoanilino)-2-[4-benzoxy-2-(methanesulfonamido)-5-methoxy-phenyl]-N-benzyl-acetamide Formula: C31H33N5O5S MolecularWeight: 587.68922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C(=O)NCC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N)NS(=O)(=O)C)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C(=O)NCC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N)NS(=O)(=O)C)OCC4=CC=CC=C4

InChI

InChI=1S/C31H33N5O5S/c1-40-27-17-25(26(36-42(2,38)39)18-28(27)41-20-22-11-7-4-8-12-22)29(31(37)34-19-21-9-5-3-6-10-21)35-24-15-13-23(14-16-24)30(32)33/h3-18,29,35-36H,19-20H2,1-2H3,(H3,32,33)(H,34,37)