1-[1-[2-(1H-inden-2-yl)ethanoyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbothioic S-acid

Systemtic Name: 1-[1-[2-(1H-inden-2-yl)ethanoyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carbothioic S-acid Openeye Name: 1-[1-[2-(1H-inden-2-yl)acetyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbothioic S-acid CAS Name: 1-[[1-[2-(1H-inden-2-yl)-1-oxoethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbothioic S-acid IUPAC Name: 1-[1-[2-(1H-inden-2-yl)acetyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbothioic S-acid Traditional Name: 1-[1-[2-(1H-inden-2-yl)acetyl]prolyl]pyrrolidine-2-carbothioic S-acid Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2=CC3=CC=CC=C3C2)C(=O)N4CCCC4C(=O)S

Isomeric SMILES

C1CC(N(C1)C(=O)CC2=CC3=CC=CC=C3C2)C(=O)N4CCCC4C(=O)S

InChI

InChI=1S/C21H24N2O3S/c24-19(13-14-11-15-5-1-2-6-16(15)12-14)22-9-3-7-17(22)20(25)23-10-4-8-18(23)21(26)27/h1-2,5-6,11,17-18H,3-4,7-10,12-13H2,(H,26,27)