butyl (2S)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: butyl (2S)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: butyl (2S)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)propanoate CAS Name: (2S)-3-(3-carbamimidoylphenyl)-2-(2-naphthalenylsulfonylamino)propanoic acid butyl ester IUPAC Name: butyl (2S)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: (2S)-3-(3-amidinophenyl)-2-(2-naphthylsulfonylamino)propionic acid butyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CC=CC(=C1)C(=N)N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCOC(=O)[C@H](CC1=CC=CC(=C1)C(=N)N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H27N3O4S/c1-2-3-13-31-24(28)22(15-17-7-6-10-20(14-17)23(25)26)27-32(29,30)21-12-11-18-8-4-5-9-19(18)16-21/h4-12,14,16,22,27H,2-3,13,15H2,1H3,(H3,25,26)/t22-/m0/s1