N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-3-(naphthalen-1-ylsulfonylamino)-2-oxidanyl-phenyl]ethanamide hydrochloride

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-3-(naphthalen-1-ylsulfonylamino)-2-oxidanyl-phenyl]ethanamide hydrochloride Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-hydroxy-6-methyl-3-(1-naphthylsulfonylamino)phenyl]acetamide hydrochloride CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-hydroxy-6-methyl-3-(1-naphthalenylsulfonylamino)phenyl]acetamide hydrochloride IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-hydroxy-6-methyl-3-(naphthalen-1-ylsulfonylamino)phenyl]acetamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-2-[2-hydroxy-6-methyl-3-(1-naphthylsulfonylamino)phenyl]acetamide hydrochloride Formula: C27H27ClN4O4S MolecularWeight: 539.04568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)NS(=O)(=O)C2=CC=CC3=CC=CC=C32)O)CC(=O)NCC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)NS(=O)(=O)C2=CC=CC3=CC=CC=C32)O)CC(=O)NCC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C27H26N4O4S.ClH/c1-17-9-14-23(31-36(34,35)24-8-4-6-19-5-2-3-7-21(19)24)26(33)22(17)15-25(32)30-16-18-10-12-20(13-11-18)27(28)29;/h2-14,31,33H,15-16H2,1H3,(H3,28,29)(H,30,32);1H