2-[(2S)-4-methyl-2-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonyl-phenylmethoxycarbonyl-amino]pentanoyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-[(2S)-4-methyl-2-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonyl-phenylmethoxycarbonyl-amino]pentanoyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-[(2S)-2-[benzyloxycarbonyl-[(2S)-5-oxopyrrolidine-2-carbonyl]amino]-4-methyl-pentanoyl]thiazolidine-4-carboxylic acid CAS Name: 2-[(2S)-4-methyl-1-oxo-2-[[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]-phenylmethoxycarbonylamino]pentyl]-4-thiazolidinecarboxylic acid IUPAC Name: 2-[(2S)-4-methyl-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]-phenylmethoxycarbonylamino]pentanoyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-[(2S)-2-[carbobenzoxy-[(2S)-5-ketoprolyl]amino]-4-methyl-pentanoyl]thiazolidine-4-carboxylic acid Formula: C23H29N3O7S MolecularWeight: 491.55726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C1NC(CS1)C(=O)O)N(C(=O)C2CCC(=O)N2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@@H](C(=O)C1NC(CS1)C(=O)O)N(C(=O)[C@@H]2CCC(=O)N2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O7S/c1-13(2)10-17(19(28)20-25-16(12-34-20)22(30)31)26(21(29)15-8-9-18(27)24-15)23(32)33-11-14-6-4-3-5-7-14/h3-7,13,15-17,20,25H,8-12H2,1-2H3,(H,24,27)(H,30,31)/t15-,16?,17-,20?/m0/s1