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

Systemtic Name: N-[(1-carbamimidoylpiperidin-3-yl)methyl]-4-morpholin-4-yl-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanamide Openeye Name: N-[(1-carbamimidoyl-3-piperidyl)methyl]-4-morpholino-3-(2-naphthylsulfonylamino)-4-oxo-butanamide CAS Name: N-[(1-carbamimidoyl-3-piperidinyl)methyl]-4-(4-morpholinyl)-3-(2-naphthalenylsulfonylamino)-4-oxobutanamide IUPAC Name: N-[(1-carbamimidoylpiperidin-3-yl)methyl]-4-morpholin-4-yl-3-(naphthalen-2-ylsulfonylamino)-4-oxobutanamide Traditional Name: N-[(1-amidino-3-piperidyl)methyl]-4-keto-4-morpholino-3-(2-naphthylsulfonylamino)butyramide Formula: C25H34N6O5S MolecularWeight: 530.63966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=N)N)CNC(=O)CC(C(=O)N2CCOCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC(CN(C1)C(=N)N)CNC(=O)CC(C(=O)N2CCOCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H34N6O5S/c26-25(27)31-9-3-4-18(17-31)16-28-23(32)15-22(24(33)30-10-12-36-13-11-30)29-37(34,35)21-8-7-19-5-1-2-6-20(19)14-21/h1-2,5-8,14,18,22,29H,3-4,9-13,15-17H2,(H3,26,27)(H,28,32)