(3S)-4-oxidanylidene-3-[[(2R)-6-[(8-oxidanylquinolin-2-yl)carbonylamino]-2-thiophen-2-yl-hexanoyl]amino]butanoic acid

Systemtic Name: (3S)-4-oxidanylidene-3-[[(2R)-6-[(8-oxidanylquinolin-2-yl)carbonylamino]-2-thiophen-2-yl-hexanoyl]amino]butanoic acid Openeye Name: (3S)-3-[[(2R)-6-[(8-hydroxyquinoline-2-carbonyl)amino]-2-(2-thienyl)hexanoyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-[[(2R)-6-[[(8-hydroxy-2-quinolinyl)-oxomethyl]amino]-1-oxo-2-thiophen-2-ylhexyl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-[[(2R)-6-[(8-hydroxyquinoline-2-carbonyl)amino]-2-thiophen-2-ylhexanoyl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-[[(2R)-6-[(8-hydroxyquinoline-2-carbonyl)amino]-2-(2-thienyl)hexanoyl]amino]-4-keto-butyric acid Formula: C24H25N3O6S MolecularWeight: 483.5368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)N=C(C=C2)C(=O)NCCCCC(C3=CC=CS3)C(=O)NC(CC(=O)O)C=O

Isomeric SMILES

C1=CC2=C(C(=C1)O)N=C(C=C2)C(=O)NCCCC[C@@H](C3=CC=CS3)C(=O)N[C@@H](CC(=O)O)C=O

InChI

InChI=1S/C24H25N3O6S/c28-14-16(13-21(30)31)26-23(32)17(20-8-4-12-34-20)6-1-2-11-25-24(33)18-10-9-15-5-3-7-19(29)22(15)27-18/h3-5,7-10,12,14,16-17,29H,1-2,6,11,13H2,(H,25,33)(H,26,32)(H,30,31)/t16-,17-/m0/s1