N-(2-ethylpiperidin-1-yl)carbothioyl-3-nitro-benzamide

Systemtic Name: N-(2-ethylpiperidin-1-yl)carbothioyl-3-nitro-benzamide Openeye Name: N-(2-ethylpiperidine-1-carbothioyl)-3-nitro-benzamide CAS Name: N-[(2-ethyl-1-piperidinyl)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-(2-ethylpiperidine-1-carbothioyl)-3-nitrobenzamide Traditional Name: N-(2-ethylpiperidine-1-carbothioyl)-3-nitro-benzamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O3S/c1-2-12-7-3-4-9-17(12)15(22)16-14(19)11-6-5-8-13(10-11)18(20)21/h5-6,8,10,12H,2-4,7,9H2,1H3,(H,16,19,22)