3-nitro-N-(4-propan-2-ylphenyl)benzenecarbothioamide

Systemtic Name: 3-nitro-N-(4-propan-2-ylphenyl)benzenecarbothioamide Openeye Name: N-(4-isopropylphenyl)-3-nitro-benzenecarbothioamide CAS Name: 3-nitro-N-(4-propan-2-ylphenyl)benzenecarbothioamide IUPAC Name: 3-nitro-N-(4-propan-2-ylphenyl)benzenecarbothioamide Traditional Name: 3-nitro-N-p-cumenyl-thiobenzamide Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O2S/c1-11(2)12-6-8-14(9-7-12)17-16(21)13-4-3-5-15(10-13)18(19)20/h3-11H,1-2H3,(H,17,21)