2-[2-oxidanylidene-3-[[2-[(phenylmethyl)carbamoylamino]-1,3-thiazol-4-yl]carbonylamino]propyl]butanedioate

Systemtic Name: 2-[2-oxidanylidene-3-[[2-[(phenylmethyl)carbamoylamino]-1,3-thiazol-4-yl]carbonylamino]propyl]butanedioate Openeye Name: 2-[3-[[2-(benzylcarbamoylamino)thiazole-4-carbonyl]amino]-2-oxo-propyl]butanedioate CAS Name: 2-[2-oxo-3-[[oxo-[2-[[oxo-[(phenylmethyl)amino]methyl]amino]-4-thiazolyl]methyl]amino]propyl]butanedioate IUPAC Name: 2-[3-[[2-(benzylcarbamoylamino)-1,3-thiazole-4-carbonyl]amino]-2-oxopropyl]butanedioate Traditional Name: 2-[3-[[2-(benzylcarbamoylamino)thiazole-4-carbonyl]amino]-2-keto-propyl]succinate Formula: C19H18N4O7S-2 MolecularWeight: 446.43382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=NC(=CS2)C(=O)NCC(=O)CC(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=NC(=CS2)C(=O)NCC(=O)CC(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C19H20N4O7S/c24-13(6-12(17(28)29)7-15(25)26)9-20-16(27)14-10-31-19(22-14)23-18(30)21-8-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2,(H,20,27)(H,25,26)(H,28,29)(H2,21,22,23,30)/p-2