4-chloranyl-N-(4-methylpiperidin-1-yl)carbothioyl-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(4-methylpiperidin-1-yl)carbothioyl-3-nitro-benzamide Openeye Name: 4-chloro-N-(4-methylpiperidine-1-carbothioyl)-3-nitro-benzamide CAS Name: 4-chloro-N-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-(4-methylpiperidine-1-carbothioyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(4-methylpiperidine-1-carbothioyl)-3-nitro-benzamide Formula: C14H16ClN3O3S MolecularWeight: 341.81314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16ClN3O3S/c1-9-4-6-17(7-5-9)14(22)16-13(19)10-2-3-11(15)12(8-10)18(20)21/h2-3,8-9H,4-7H2,1H3,(H,16,19,22)