N-[(4-carbamimidoylphenyl)methyl]-2-[4-methyl-6-oxidanylidene-1-(phenylsulfonylamino)-2,3-dihydropyridin-5-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[4-methyl-6-oxidanylidene-1-(phenylsulfonylamino)-2,3-dihydropyridin-5-yl]ethanamide Openeye Name: 2-[1-(benzenesulfonamido)-4-methyl-6-oxo-2,3-dihydropyridin-5-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: 2-[1-(benzenesulfonamido)-4-methyl-6-oxo-2,3-dihydropyridin-5-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide IUPAC Name: 2-[1-(benzenesulfonamido)-4-methyl-6-oxo-2,3-dihydropyridin-5-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[1-(benzenesulfonamido)-6-keto-4-methyl-2,3-dihydropyridin-5-yl]acetamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(CC1)NS(=O)(=O)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=C(C(=O)N(CC1)NS(=O)(=O)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H25N5O4S/c1-15-11-12-27(26-32(30,31)18-5-3-2-4-6-18)22(29)19(15)13-20(28)25-14-16-7-9-17(10-8-16)21(23)24/h2-10,26H,11-14H2,1H3,(H3,23,24)(H,25,28)