2-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[4-(3-sulfamoylphenyl)phenyl]pentanamide

Systemtic Name: 2-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[4-(3-sulfamoylphenyl)phenyl]pentanamide Openeye Name: 2-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[4-(3-sulfamoylphenyl)phenyl]pentanamide CAS Name: 2-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[4-(3-sulfamoylphenyl)phenyl]pentanamide IUPAC Name: 2-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-[4-(3-sulfamoylphenyl)phenyl]pentanamide Traditional Name: 2-(3-amidinobenzyl)-4-methyl-N-[4-(3-sulfamoylphenyl)phenyl]valeramide Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC1=CC=CC(=C1)C(=N)N)C(=O)NC2=CC=C(C=C2)C3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

CC(C)CC(CC1=CC=CC(=C1)C(=N)N)C(=O)NC2=CC=C(C=C2)C3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C26H30N4O3S/c1-17(2)13-22(15-18-5-3-7-21(14-18)25(27)28)26(31)30-23-11-9-19(10-12-23)20-6-4-8-24(16-20)34(29,32)33/h3-12,14,16-17,22H,13,15H2,1-2H3,(H3,27,28)(H,30,31)(H2,29,32,33)