N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]pyridin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]pyridin-1-yl]ethanamide Openeye Name: 2-[3-(benzylsulfonylamino)-6-methyl-2-oxo-1-pyridyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-methyl-2-oxo-3-[(phenylmethyl)sulfonylamino]-1-pyridinyl]acetamide IUPAC Name: 2-[3-(benzylsulfonylamino)-6-methyl-2-oxopyridin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(benzylsulfonylamino)-2-keto-6-methyl-1-pyridyl]acetamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1CC(=O)NCC2=CC=C(C=C2)C(=N)N)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C(=O)N1CC(=O)NCC2=CC=C(C=C2)C(=N)N)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H25N5O4S/c1-16-7-12-20(27-33(31,32)15-18-5-3-2-4-6-18)23(30)28(16)14-21(29)26-13-17-8-10-19(11-9-17)22(24)25/h2-12,27H,13-15H2,1H3,(H3,24,25)(H,26,29)