N-[(4-carbamimidoylphenyl)methyl]-2-[4-methyl-1-(naphthalen-1-ylsulfonylamino)-2-oxidanylidene-pyridin-3-yl]ethanamide hydrochloride

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[4-methyl-1-(naphthalen-1-ylsulfonylamino)-2-oxidanylidene-pyridin-3-yl]ethanamide hydrochloride Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[4-methyl-1-(1-naphthylsulfonylamino)-2-oxo-3-pyridyl]acetamide hydrochloride CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[4-methyl-1-(1-naphthalenylsulfonylamino)-2-oxo-3-pyridinyl]acetamide hydrochloride IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[4-methyl-1-(naphthalen-1-ylsulfonylamino)-2-oxopyridin-3-yl]acetamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-2-[2-keto-4-methyl-1-(1-naphthylsulfonylamino)-3-pyridyl]acetamide hydrochloride Formula: C26H26ClN5O4S MolecularWeight: 540.03374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25N5O4S.ClH/c1-17-13-14-31(30-36(34,35)23-8-4-6-19-5-2-3-7-21(19)23)26(33)22(17)15-24(32)29-16-18-9-11-20(12-10-18)25(27)28;/h2-14,30H,15-16H2,1H3,(H3,27,28)(H,29,32);1H