N-[(3S)-1-carbamimidoyl-2-oxidanyl-piperidin-3-yl]-2-[(3S)-3-(naphthalen-1-ylsulfonylamino)-2-oxidanylidene-piperidin-1-yl]ethanamide

Systemtic Name: N-[(3S)-1-carbamimidoyl-2-oxidanyl-piperidin-3-yl]-2-[(3S)-3-(naphthalen-1-ylsulfonylamino)-2-oxidanylidene-piperidin-1-yl]ethanamide Openeye Name: N-[(3S)-1-carbamimidoyl-2-hydroxy-3-piperidyl]-2-[(3S)-3-(1-naphthylsulfonylamino)-2-oxo-1-piperidyl]acetamide CAS Name: N-[(3S)-1-carbamimidoyl-2-hydroxy-3-piperidinyl]-2-[(3S)-3-(1-naphthalenylsulfonylamino)-2-oxo-1-piperidinyl]acetamide IUPAC Name: N-[(3S)-1-carbamimidoyl-2-hydroxypiperidin-3-yl]-2-[(3S)-3-(naphthalen-1-ylsulfonylamino)-2-oxopiperidin-1-yl]acetamide Traditional Name: N-[(3S)-1-amidino-2-hydroxy-3-piperidyl]-2-[(3S)-2-keto-3-(1-naphthylsulfonylamino)piperidino]acetamide Formula: C23H30N6O5S MolecularWeight: 502.5865

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(N(C1)C(=N)N)O)NC(=O)CN2CCCC(C2=O)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1C[C@@H](C(N(C1)C(=N)N)O)NC(=O)CN2CCC[C@@H](C2=O)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H30N6O5S/c24-23(25)29-13-5-9-17(22(29)32)26-20(30)14-28-12-4-10-18(21(28)31)27-35(33,34)19-11-3-7-15-6-1-2-8-16(15)19/h1-3,6-8,11,17-18,22,27,32H,4-5,9-10,12-14H2,(H3,24,25)(H,26,30)/t17-,18-,22?/m0/s1