1-[(2-chloranyl-5-nitro-phenyl)carbamothioyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-5-nitro-phenyl)carbamothioyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-5-nitro-phenyl)carbamothioyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[(2-chloro-5-nitroanilino)-sulfanylidenemethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-5-nitrophenyl)carbamothioyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[(2-chloro-5-nitro-phenyl)thiocarbamoyl]-N-phenyl-isonipecotamide Formula: C19H19ClN4O3S MolecularWeight: 418.89716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H19ClN4O3S/c20-16-7-6-15(24(26)27)12-17(16)22-19(28)23-10-8-13(9-11-23)18(25)21-14-4-2-1-3-5-14/h1-7,12-13H,8-11H2,(H,21,25)(H,22,28)