(2S)-3-[2-(4-azanylbutanoylamino)ethylamino]-2-(phenylsulfonylamino)propanoic acid

Systemtic Name: (2S)-3-[2-(4-azanylbutanoylamino)ethylamino]-2-(phenylsulfonylamino)propanoic acid Openeye Name: (2S)-3-[2-(4-aminobutanoylamino)ethylamino]-2-(benzenesulfonamido)propanoic acid CAS Name: (2S)-3-[2-[(4-amino-1-oxobutyl)amino]ethylamino]-2-(benzenesulfonamido)propanoic acid IUPAC Name: (2S)-3-[2-(4-aminobutanoylamino)ethylamino]-2-(benzenesulfonamido)propanoic acid Traditional Name: (2S)-3-[2-(4-aminobutanoylamino)ethylamino]-2-(benzenesulfonamido)propionic acid Formula: C15H24N4O5S MolecularWeight: 372.43986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC(CNCCNC(=O)CCCN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N[C@@H](CNCCNC(=O)CCCN)C(=O)O

InChI

InChI=1S/C15H24N4O5S/c16-8-4-7-14(20)18-10-9-17-11-13(15(21)22)19-25(23,24)12-5-2-1-3-6-12/h1-3,5-6,13,17,19H,4,7-11,16H2,(H,18,20)(H,21,22)/t13-/m0/s1