(2S)-2-azaniumyl-5-(carbamothioylamino)pentanoate

Systemtic Name: (2S)-2-azaniumyl-5-(carbamothioylamino)pentanoate Openeye Name: (2S)-2-azaniumyl-5-(carbamothioylamino)pentanoate CAS Name: (2S)-2-ammonio-5-(carbamothioylamino)pentanoate IUPAC Name: (2S)-2-azaniumyl-5-(carbamothioylamino)pentanoate Traditional Name: (2S)-2-ammonio-5-thioureido-valerate Formula: C6H13N3O2S MolecularWeight: 191.25132

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)[O-])[NH3+])CNC(=S)N

Isomeric SMILES

C(C[C@@H](C(=O)[O-])[NH3+])CNC(=S)N

InChI

InChI=1S/C6H13N3O2S/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m0/s1