N-(2-diethylaminoethylcarbamothioyl)-4-nitro-benzamide

Systemtic Name: N-(2-diethylaminoethylcarbamothioyl)-4-nitro-benzamide Openeye Name: N-(2-diethylaminoethylcarbamothioyl)-4-nitro-benzamide CAS Name: N-[(2-diethylaminoethylamino)-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-(2-diethylaminoethylcarbamothioyl)-4-nitrobenzamide Traditional Name: N-(2-diethylaminoethylthiocarbamoyl)-4-nitro-benzamide Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O3S/c1-3-17(4-2)10-9-15-14(22)16-13(19)11-5-7-12(8-6-11)18(20)21/h5-8H,3-4,9-10H2,1-2H3,(H2,15,16,19,22)