N-[1-[(5-carbamimidoylpyridin-2-yl)methylamino]-1-oxidanylidene-propan-2-yl]-3-oxidanyl-2-[(phenylmethyl)sulfonylamino]propanamide

Systemtic Name: N-[1-[(5-carbamimidoylpyridin-2-yl)methylamino]-1-oxidanylidene-propan-2-yl]-3-oxidanyl-2-[(phenylmethyl)sulfonylamino]propanamide Openeye Name: 2-(benzylsulfonylamino)-N-[2-[(5-carbamimidoyl-2-pyridyl)methylamino]-1-methyl-2-oxo-ethyl]-3-hydroxy-propanamide CAS Name: N-[1-[(5-carbamimidoyl-2-pyridinyl)methylamino]-1-oxopropan-2-yl]-3-hydroxy-2-[(phenylmethyl)sulfonylamino]propanamide IUPAC Name: 2-(benzylsulfonylamino)-N-[1-[(5-carbamimidoylpyridin-2-yl)methylamino]-1-oxopropan-2-yl]-3-hydroxypropanamide Traditional Name: N-[2-[(5-amidino-2-pyridyl)methylamino]-2-keto-1-methyl-ethyl]-2-(benzylsulfonylamino)-3-hydroxy-propionamide Formula: C20H26N6O5S MolecularWeight: 462.52264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=NC=C(C=C1)C(=N)N)NC(=O)C(CO)NS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCC1=NC=C(C=C1)C(=N)N)NC(=O)C(CO)NS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H26N6O5S/c1-13(19(28)24-10-16-8-7-15(9-23-16)18(21)22)25-20(29)17(11-27)26-32(30,31)12-14-5-3-2-4-6-14/h2-9,13,17,26-27H,10-12H2,1H3,(H3,21,22)(H,24,28)(H,25,29)