2-[[5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanethioyl]amino]ethanoic acid

Systemtic Name: 2-[[5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanethioyl]amino]ethanoic acid Openeye Name: 2-[[5-amino-2-(benzyloxycarbonylamino)-5-oxo-pentanethioyl]amino]acetic acid CAS Name: 2-[[5-amino-5-oxo-2-(phenylmethoxycarbonylamino)-1-sulfanylidenepentyl]amino]acetic acid IUPAC Name: 2-[[5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanethioyl]amino]acetic acid Traditional Name: 2-[[5-amino-2-(benzyloxycarbonylamino)-5-keto-pentanethioyl]amino]acetic acid Formula: C15H19N3O5S MolecularWeight: 353.39346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCC(=O)N)C(=S)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCC(=O)N)C(=S)NCC(=O)O

InChI

InChI=1S/C15H19N3O5S/c16-12(19)7-6-11(14(24)17-8-13(20)21)18-15(22)23-9-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H2,16,19)(H,17,24)(H,18,22)(H,20,21)