methyl 3-[[(3S,5S)-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoate

Systemtic Name: methyl 3-[[(3S,5S)-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoate Openeye Name: methyl 3-[[(3S,5S)-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoate CAS Name: 3-[oxo-[[(3S,5S)-5-[oxo(3-thiazolidinyl)methyl]-3-pyrrolidinyl]methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(3S,5S)-5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoate Traditional Name: 3-[[(3S,5S)-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]methylcarbamoyl]benzoic acid methyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NCC2CC(NC2)C(=O)N3CCSC3

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NC[C@H]2C[C@H](NC2)C(=O)N3CCSC3

InChI

InChI=1S/C18H23N3O4S/c1-25-18(24)14-4-2-3-13(8-14)16(22)20-10-12-7-15(19-9-12)17(23)21-5-6-26-11-21/h2-4,8,12,15,19H,5-7,9-11H2,1H3,(H,20,22)/t12-,15-/m0/s1