5-azanyl-2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[2-[(2-methylthiazol-4-yl)methylsulfanyl]acetyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-[(2-methyl-4-thiazolyl)methylthio]-1-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[[2-[(2-methylthiazol-4-yl)methylthio]acetyl]amino]valeric acid Formula: C12H17N3O4S2 MolecularWeight: 331.41108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCC(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)CSCC(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C12H17N3O4S2/c1-7-14-8(5-21-7)4-20-6-11(17)15-9(12(18)19)2-3-10(13)16/h5,9H,2-4,6H2,1H3,(H2,13,16)(H,15,17)(H,18,19)