5-oxidanylidene-6-[[2-[(phenylmethyl)carbamoylamino]-1,3-thiazol-4-yl]carbonylamino]hexanoic acid

Systemtic Name: 5-oxidanylidene-6-[[2-[(phenylmethyl)carbamoylamino]-1,3-thiazol-4-yl]carbonylamino]hexanoic acid Openeye Name: 6-[[2-(benzylcarbamoylamino)thiazole-4-carbonyl]amino]-5-oxo-hexanoic acid CAS Name: 5-oxo-6-[[oxo-[2-[[oxo-[(phenylmethyl)amino]methyl]amino]-4-thiazolyl]methyl]amino]hexanoic acid IUPAC Name: 6-[[2-(benzylcarbamoylamino)-1,3-thiazole-4-carbonyl]amino]-5-oxohexanoic acid Traditional Name: 6-[[2-(benzylcarbamoylamino)thiazole-4-carbonyl]amino]-5-keto-hexanoic acid Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=NC(=CS2)C(=O)NCC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=NC(=CS2)C(=O)NCC(=O)CCCC(=O)O

InChI

InChI=1S/C18H20N4O5S/c23-13(7-4-8-15(24)25)10-19-16(26)14-11-28-18(21-14)22-17(27)20-9-12-5-2-1-3-6-12/h1-3,5-6,11H,4,7-10H2,(H,19,26)(H,24,25)(H2,20,21,22,27)