2-[6-(1H-inden-2-yl)hexanoyl]-1-pyrrolidin-2-ylcarbonyl-pyrrolidine-2-carbothioic S-acid

Systemtic Name: 2-[6-(1H-inden-2-yl)hexanoyl]-1-pyrrolidin-2-ylcarbonyl-pyrrolidine-2-carbothioic S-acid Openeye Name: 2-[6-(1H-inden-2-yl)hexanoyl]-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbothioic S-acid CAS Name: 2-[6-(1H-inden-2-yl)-1-oxohexyl]-1-[oxo(2-pyrrolidinyl)methyl]-2-pyrrolidinecarbothioic S-acid IUPAC Name: 2-[6-(1H-inden-2-yl)hexanoyl]-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbothioic S-acid Traditional Name: 2-[6-(1H-inden-2-yl)hexanoyl]-1-prolyl-pyrrolidine-2-carbothioic S-acid Formula: C25H32N2O3S MolecularWeight: 440.59818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)N2CCCC2(C(=O)CCCCCC3=CC4=CC=CC=C4C3)C(=O)S

Isomeric SMILES

C1CC(NC1)C(=O)N2CCCC2(C(=O)CCCCCC3=CC4=CC=CC=C4C3)C(=O)S

InChI

InChI=1S/C25H32N2O3S/c28-22(12-3-1-2-8-18-16-19-9-4-5-10-20(19)17-18)25(24(30)31)13-7-15-27(25)23(29)21-11-6-14-26-21/h4-5,9-10,16,21,26H,1-3,6-8,11-15,17H2,(H,30,31)