2-[5-[(1-methylpyrrol-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(1-oxidanyl-3-phenyl-propan-2-yl)propanamide

Systemtic Name: 2-[5-[(1-methylpyrrol-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(1-oxidanyl-3-phenyl-propan-2-yl)propanamide Openeye Name: N-(1-benzyl-2-hydroxy-ethyl)-2-[5-[(1-methylpyrrol-2-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanamide CAS Name: N-(1-hydroxy-3-phenylpropan-2-yl)-2-[5-[(1-methyl-2-pyrrolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanamide IUPAC Name: N-(1-hydroxy-3-phenylpropan-2-yl)-2-[5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide Traditional Name: N-(1-benzyl-2-hydroxy-ethyl)-2-[4-keto-5-[(1-methylpyrrol-2-yl)methylene]-2-thioxo-thiazolidin-3-yl]propionamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)CO)N2C(=O)C(=CC3=CC=CN3C)SC2=S

Isomeric SMILES

CC(C(=O)NC(CC1=CC=CC=C1)CO)N2C(=O)C(=CC3=CC=CN3C)SC2=S

InChI

InChI=1S/C21H23N3O3S2/c1-14(19(26)22-16(13-25)11-15-7-4-3-5-8-15)24-20(27)18(29-21(24)28)12-17-9-6-10-23(17)2/h3-10,12,14,16,25H,11,13H2,1-2H3,(H,22,26)