2-[[2-[(4-acetamido-5-ethoxy-5-oxidanylidene-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[(4-acetamido-5-ethoxy-5-oxidanylidene-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[(4-acetamido-5-ethoxy-5-oxo-pentanoyl)amino]-3-sulfanyl-propanoyl]amino]acetic acid CAS Name: 2-[[2-[(4-acetamido-5-ethoxy-1,5-dioxopentyl)amino]-3-mercapto-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[[2-[(4-acetamido-5-ethoxy-5-oxopentanoyl)amino]-3-sulfanylpropanoyl]amino]acetic acid Traditional Name: 2-[[2-[(4-acetamido-5-ethoxy-5-keto-pentanoyl)amino]-3-mercapto-propanoyl]amino]acetic acid Formula: C14H23N3O7S MolecularWeight: 377.41332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)NC(CS)C(=O)NCC(=O)O)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCC(=O)NC(CS)C(=O)NCC(=O)O)NC(=O)C

InChI

InChI=1S/C14H23N3O7S/c1-3-24-14(23)9(16-8(2)18)4-5-11(19)17-10(7-25)13(22)15-6-12(20)21/h9-10,25H,3-7H2,1-2H3,(H,15,22)(H,16,18)(H,17,19)(H,20,21)