N-(4-methylpiperidin-1-yl)carbothioyl-4-nitro-benzamide

Systemtic Name: N-(4-methylpiperidin-1-yl)carbothioyl-4-nitro-benzamide Openeye Name: N-(4-methylpiperidine-1-carbothioyl)-4-nitro-benzamide CAS Name: N-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-(4-methylpiperidine-1-carbothioyl)-4-nitrobenzamide Traditional Name: N-(4-methylpiperidine-1-carbothioyl)-4-nitro-benzamide Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O3S/c1-10-6-8-16(9-7-10)14(21)15-13(18)11-2-4-12(5-3-11)17(19)20/h2-5,10H,6-9H2,1H3,(H,15,18,21)