3-nitro-N-(2,2,4,6-tetramethylquinolin-1-yl)carbothioyl-benzamide

Systemtic Name: 3-nitro-N-(2,2,4,6-tetramethylquinolin-1-yl)carbothioyl-benzamide Openeye Name: 3-nitro-N-(2,2,4,6-tetramethylquinoline-1-carbothioyl)benzamide CAS Name: 3-nitro-N-[sulfanylidene-(2,2,4,6-tetramethyl-1-quinolinyl)methyl]benzamide IUPAC Name: 3-nitro-N-(2,2,4,6-tetramethylquinoline-1-carbothioyl)benzamide Traditional Name: 3-nitro-N-(2,2,4,6-tetramethylquinoline-1-carbothioyl)benzamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(C=C2C)(C)C)C(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O3S/c1-13-8-9-18-17(10-13)14(2)12-21(3,4)23(18)20(28)22-19(25)15-6-5-7-16(11-15)24(26)27/h5-12H,1-4H3,(H,22,25,28)