2-nitro-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-nitro-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Openeye Name: N-[(2-isopropylphenyl)carbamothioyl]-2-nitro-benzamide CAS Name: 2-nitro-N-[(2-propan-2-ylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-nitro-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Traditional Name: 2-nitro-N-(o-cumenylthiocarbamoyl)benzamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O3S/c1-11(2)12-7-3-5-9-14(12)18-17(24)19-16(21)13-8-4-6-10-15(13)20(22)23/h3-11H,1-2H3,(H2,18,19,21,24)