3-[1-[2-(2,3-dihydro-1H-inden-2-yl)ethanoyl]piperidin-2-yl]carbonyl-4-sulfanylidene-pyrrolidine-2-carbaldehyde

Systemtic Name: 3-[1-[2-(2,3-dihydro-1H-inden-2-yl)ethanoyl]piperidin-2-yl]carbonyl-4-sulfanylidene-pyrrolidine-2-carbaldehyde Openeye Name: 3-[1-(2-indan-2-ylacetyl)piperidine-2-carbonyl]-4-thioxo-pyrrolidine-2-carbaldehyde CAS Name: 3-[[1-[2-(2,3-dihydro-1H-inden-2-yl)-1-oxoethyl]-2-piperidinyl]-oxomethyl]-4-sulfanylidene-2-pyrrolidinecarboxaldehyde IUPAC Name: 3-[1-[2-(2,3-dihydro-1H-inden-2-yl)acetyl]piperidine-2-carbonyl]-4-sulfanylidenepyrrolidine-2-carbaldehyde Traditional Name: 3-[1-(2-indan-2-ylacetyl)pipecoloyl]-4-thioxo-pyrrolidine-2-carbaldehyde Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)C2C(NCC2=S)C=O)C(=O)CC3CC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C(C1)C(=O)C2C(NCC2=S)C=O)C(=O)CC3CC4=CC=CC=C4C3

InChI

InChI=1S/C22H26N2O3S/c25-13-17-21(19(28)12-23-17)22(27)18-7-3-4-8-24(18)20(26)11-14-9-15-5-1-2-6-16(15)10-14/h1-2,5-6,13-14,17-18,21,23H,3-4,7-12H2