N-(4-methylsulfanylphenyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide

Systemtic Name: N-(4-methylsulfanylphenyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide Openeye Name: N-(4-methylsulfanylphenyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide CAS Name: N-[4-(methylthio)phenyl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-piperidinecarboxamide IUPAC Name: N-(4-methylsulfanylphenyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide Traditional Name: N-[4-(methylthio)phenyl]-4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S/c1-28-18-9-7-17(8-10-18)22-21(26)25-13-11-16(12-14-25)20-23-19(24-27-20)15-5-3-2-4-6-15/h2-10,16H,11-14H2,1H3,(H,22,26)