N-[cyclohexyl(methyl)carbamothioyl]-4-nitro-benzamide

Systemtic Name: N-[cyclohexyl(methyl)carbamothioyl]-4-nitro-benzamide Openeye Name: N-[cyclohexyl(methyl)carbamothioyl]-4-nitro-benzamide CAS Name: N-[[cyclohexyl(methyl)amino]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[cyclohexyl(methyl)carbamothioyl]-4-nitrobenzamide Traditional Name: N-[cyclohexyl(methyl)thiocarbamoyl]-4-nitro-benzamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCCC1)C(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O3S/c1-17(12-5-3-2-4-6-12)15(22)16-14(19)11-7-9-13(10-8-11)18(20)21/h7-10,12H,2-6H2,1H3,(H,16,19,22)