4-(2-aminophenyl)-N-[(1-carbamimidoylpiperidin-3-yl)methyl]-2-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanamide

Systemtic Name: 4-(2-aminophenyl)-N-[(1-carbamimidoylpiperidin-3-yl)methyl]-2-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanamide Openeye Name: 4-(2-aminophenyl)-N-[(1-carbamimidoyl-3-piperidyl)methyl]-2-(2-naphthylsulfonylamino)-4-oxo-butanamide CAS Name: 4-(2-aminophenyl)-N-[(1-carbamimidoyl-3-piperidinyl)methyl]-2-(2-naphthalenylsulfonylamino)-4-oxobutanamide IUPAC Name: 4-(2-aminophenyl)-N-[(1-carbamimidoylpiperidin-3-yl)methyl]-2-(naphthalen-2-ylsulfonylamino)-4-oxobutanamide Traditional Name: N-[(1-amidino-3-piperidyl)methyl]-4-(2-aminophenyl)-4-keto-2-(2-naphthylsulfonylamino)butyramide Formula: C27H32N6O4S MolecularWeight: 536.64578

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=N)N)CNC(=O)C(CC(=O)C2=CC=CC=C2N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC(CN(C1)C(=N)N)CNC(=O)C(CC(=O)C2=CC=CC=C2N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H32N6O4S/c28-23-10-4-3-9-22(23)25(34)15-24(26(35)31-16-18-6-5-13-33(17-18)27(29)30)32-38(36,37)21-12-11-19-7-1-2-8-20(19)14-21/h1-4,7-12,14,18,24,32H,5-6,13,15-17,28H2,(H3,29,30)(H,31,35)