methyl (2S)-2-azanyl-5-(carbamothioylamino)pentanoate

Systemtic Name: methyl (2S)-2-azanyl-5-(carbamothioylamino)pentanoate Openeye Name: methyl (2S)-2-amino-5-(carbamothioylamino)pentanoate CAS Name: (2S)-2-amino-5-(carbamothioylamino)pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-5-(carbamothioylamino)pentanoate Traditional Name: (2S)-2-amino-5-thioureido-valeric acid methyl ester Formula: C7H15N3O2S MolecularWeight: 205.2779

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCNC(=S)N)N

Isomeric SMILES

COC(=O)[C@H](CCCNC(=S)N)N

InChI

InChI=1S/C7H15N3O2S/c1-12-6(11)5(8)3-2-4-10-7(9)13/h5H,2-4,8H2,1H3,(H3,9,10,13)/t5-/m0/s1