5-[(1-methylpyrrol-2-yl)methylidene]-3-[2-oxidanylidene-2-(2-pyridin-3-ylpiperidin-1-yl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(1-methylpyrrol-2-yl)methylidene]-3-[2-oxidanylidene-2-(2-pyridin-3-ylpiperidin-1-yl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[(1-methylpyrrol-2-yl)methylene]-3-[2-oxo-2-[2-(3-pyridyl)-1-piperidyl]ethyl]-2-thioxo-thiazolidin-4-one CAS Name: 5-[(1-methyl-2-pyrrolyl)methylidene]-3-[2-oxo-2-[2-(3-pyridinyl)-1-piperidinyl]ethyl]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(1-methylpyrrol-2-yl)methylidene]-3-[2-oxo-2-(2-pyridin-3-ylpiperidin-1-yl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-[2-keto-2-[2-(3-pyridyl)piperidino]ethyl]-5-[(1-methylpyrrol-2-yl)methylene]-2-thioxo-thiazolidin-4-one Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=C2C(=O)N(C(=S)S2)CC(=O)N3CCCCC3C4=CN=CC=C4

Isomeric SMILES

CN1C=CC=C1C=C2C(=O)N(C(=S)S2)CC(=O)N3CCCCC3C4=CN=CC=C4

InChI

InChI=1S/C21H22N4O2S2/c1-23-10-5-7-16(23)12-18-20(27)25(21(28)29-18)14-19(26)24-11-3-2-8-17(24)15-6-4-9-22-13-15/h4-7,9-10,12-13,17H,2-3,8,11,14H2,1H3