(2R)-5-azanyl-5-oxidanylidene-2-(phenylcarbamothioylamino)pentanoate

Systemtic Name: (2R)-5-azanyl-5-oxidanylidene-2-(phenylcarbamothioylamino)pentanoate Openeye Name: (2R)-5-amino-5-oxo-2-(phenylcarbamothioylamino)pentanoate CAS Name: (2R)-5-amino-2-[[anilino(sulfanylidene)methyl]amino]-5-oxopentanoate IUPAC Name: (2R)-5-amino-5-oxo-2-(phenylcarbamothioylamino)pentanoate Traditional Name: (2R)-5-amino-5-keto-2-(phenylthiocarbamoylamino)valerate Formula: C12H14N3O3S- MolecularWeight: 280.32286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC(CCC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)N[C@H](CCC(=O)N)C(=O)[O-]

InChI

InChI=1S/C12H15N3O3S/c13-10(16)7-6-9(11(17)18)15-12(19)14-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,13,16)(H,17,18)(H2,14,15,19)/p-1/t9-/m1/s1