2-[(4-carbamimidoylphenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)-N-(phenylsulfonyl)ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)-N-(phenylsulfonyl)ethanamide Openeye Name: N-(benzenesulfonyl)-2-(4-benzyloxy-3-methoxy-phenyl)-2-(4-carbamimidoylanilino)acetamide CAS Name: N-(benzenesulfonyl)-2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)acetamide IUPAC Name: N-(benzenesulfonyl)-2-(4-carbamimidoylanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)acetamide Traditional Name: 2-(4-amidinoanilino)-2-(4-benzoxy-3-methoxy-phenyl)-N-besyl-acetamide Formula: C29H28N4O5S MolecularWeight: 544.62142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H28N4O5S/c1-37-26-18-22(14-17-25(26)38-19-20-8-4-2-5-9-20)27(32-23-15-12-21(13-16-23)28(30)31)29(34)33-39(35,36)24-10-6-3-7-11-24/h2-18,27,32H,19H2,1H3,(H3,30,31)(H,33,34)