N-(4-methylsulfanylphenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-(4-methylsulfanylphenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-(4-methylsulfanylphenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[4-(methylthio)phenyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-(4-methylsulfanylphenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[4-(methylthio)phenyl]-1-(2-nitrophenyl)isonipecotamide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-26-16-8-6-15(7-9-16)20-19(23)14-10-12-21(13-11-14)17-4-2-3-5-18(17)22(24)25/h2-9,14H,10-13H2,1H3,(H,20,23)