N-(cyclohexylcarbamothioyl)-3-nitro-benzamide

Systemtic Name: N-(cyclohexylcarbamothioyl)-3-nitro-benzamide Openeye Name: N-(cyclohexylcarbamothioyl)-3-nitro-benzamide CAS Name: N-[(cyclohexylamino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-(cyclohexylcarbamothioyl)-3-nitrobenzamide Traditional Name: N-(cyclohexylthiocarbamoyl)-3-nitro-benzamide Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O3S/c18-13(10-5-4-8-12(9-10)17(19)20)16-14(21)15-11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7H2,(H2,15,16,18,21)