(2S)-2-azanyl-5-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[(5-ethoxycarbonyl-4-methyl-thiazol-2-yl)amino]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[(5-ethoxycarbonyl-4-methyl-2-thiazolyl)amino]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[(5-carbethoxy-4-methyl-thiazol-2-yl)amino]-5-keto-valeric acid Formula: C12H17N3O5S MolecularWeight: 315.34548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CCC(C(=O)O)N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CC[C@@H](C(=O)O)N)C

InChI

InChI=1S/C12H17N3O5S/c1-3-20-11(19)9-6(2)14-12(21-9)15-8(16)5-4-7(13)10(17)18/h7H,3-5,13H2,1-2H3,(H,17,18)(H,14,15,16)/t7-/m0/s1