2-phenylmethoxycarbonyl-1-pyrrolidin-2-ylcarbonyl-pyrrolidine-2-carbothioic S-acid

Systemtic Name: 2-phenylmethoxycarbonyl-1-pyrrolidin-2-ylcarbonyl-pyrrolidine-2-carbothioic S-acid Openeye Name: 2-benzyloxycarbonyl-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbothioic S-acid CAS Name: 1-[oxo(2-pyrrolidinyl)methyl]-2-phenylmethoxycarbonyl-2-pyrrolidinecarbothioic S-acid IUPAC Name: 2-phenylmethoxycarbonyl-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbothioic S-acid Traditional Name: 2-carbobenzoxy-1-prolyl-pyrrolidine-2-carbothioic S-acid Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N2CCCC2(C(=O)OCC3=CC=CC=C3)C(=O)S

Isomeric SMILES

C1CC(NC1)C(=O)N2CCCC2(C(=O)OCC3=CC=CC=C3)C(=O)S

InChI

InChI=1S/C18H22N2O4S/c21-15(14-8-4-10-19-14)20-11-5-9-18(20,17(23)25)16(22)24-12-13-6-2-1-3-7-13/h1-3,6-7,14,19H,4-5,8-12H2,(H,23,25)