N-morpholin-4-ylcarbothioyl-4-nitro-benzamide

Systemtic Name: N-morpholin-4-ylcarbothioyl-4-nitro-benzamide Openeye Name: N-(morpholine-4-carbothioyl)-4-nitro-benzamide CAS Name: N-[4-morpholinyl(sulfanylidene)methyl]-4-nitrobenzamide IUPAC Name: N-(morpholine-4-carbothioyl)-4-nitrobenzamide Traditional Name: N-(morpholine-4-carbothioyl)-4-nitro-benzamide Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O4S/c16-11(9-1-3-10(4-2-9)15(17)18)13-12(20)14-5-7-19-8-6-14/h1-4H,5-8H2,(H,13,16,20)