5-[1-acetamido-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanyl-propyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-[1-acetamido-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanyl-propyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Openeye Name: 5-[1-acetamido-2-hydroxy-3-(4-methylthiazol-2-yl)propyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 5-[1-acetamido-2-hydroxy-3-(4-methyl-2-thiazolyl)propyl]-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-[1-acetamido-2-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)propyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-[1-acetamido-2-hydroxy-3-(4-methylthiazol-2-yl)propyl]-4-[(E)-prop-1-enyl]proline Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1CC(NC1C(C(CC2=NC(=CS2)C)O)NC(=O)C)C(=O)O

Isomeric SMILES

C/C=C/C1CC(NC1C(C(CC2=NC(=CS2)C)O)NC(=O)C)C(=O)O

InChI

InChI=1S/C17H25N3O4S/c1-4-5-11-6-12(17(23)24)20-15(11)16(19-10(3)21)13(22)7-14-18-9(2)8-25-14/h4-5,8,11-13,15-16,20,22H,6-7H2,1-3H3,(H,19,21)(H,23,24)/b5-4+