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

Systemtic Name: N-[1-[(5-carbamimidoylthiophen-2-yl)methylamino]-1-oxidanylidene-propan-2-yl]-3-oxidanyl-2-[(phenylmethyl)sulfonylamino]propanamide Openeye Name: 2-(benzylsulfonylamino)-N-[2-[(5-carbamimidoyl-2-thienyl)methylamino]-1-methyl-2-oxo-ethyl]-3-hydroxy-propanamide CAS Name: N-[1-[(5-carbamimidoyl-2-thiophenyl)methylamino]-1-oxopropan-2-yl]-3-hydroxy-2-[(phenylmethyl)sulfonylamino]propanamide IUPAC Name: 2-(benzylsulfonylamino)-N-[1-[(5-carbamimidoylthiophen-2-yl)methylamino]-1-oxopropan-2-yl]-3-hydroxypropanamide Traditional Name: N-[2-[(5-amidino-2-thienyl)methylamino]-2-keto-1-methyl-ethyl]-2-(benzylsulfonylamino)-3-hydroxy-propionamide Formula: C19H25N5O5S2 MolecularWeight: 467.5623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(S1)C(=N)N)NC(=O)C(CO)NS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCC1=CC=C(S1)C(=N)N)NC(=O)C(CO)NS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H25N5O5S2/c1-12(18(26)22-9-14-7-8-16(30-14)17(20)21)23-19(27)15(10-25)24-31(28,29)11-13-5-3-2-4-6-13/h2-8,12,15,24-25H,9-11H2,1H3,(H3,20,21)(H,22,26)(H,23,27)