N-(3-methylphenyl)-4-[(5Z)-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide

Systemtic Name: N-(3-methylphenyl)-4-[(5Z)-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide Openeye Name: N-(m-tolyl)-4-[(5Z)-5-[(3-nitrophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanamide CAS Name: N-(3-methylphenyl)-4-[(5Z)-5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanamide IUPAC Name: N-(3-methylphenyl)-4-[(5Z)-5-[(3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanamide Traditional Name: 4-[(5Z)-4-keto-5-(3-nitrobenzylidene)-2-thioxo-thiazolidin-3-yl]-N-(m-tolyl)butyramide Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCCN2C(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])SC2=S

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCCN2C(=O)/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/SC2=S

InChI

InChI=1S/C21H19N3O4S2/c1-14-5-2-7-16(11-14)22-19(25)9-4-10-23-20(26)18(30-21(23)29)13-15-6-3-8-17(12-15)24(27)28/h2-3,5-8,11-13H,4,9-10H2,1H3,(H,22,25)/b18-13-