2-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinoline-4-carboxamide

Systemtic Name: 2-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinoline-4-carboxamide Openeye Name: 2-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide CAS Name: 2-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinolinecarboxamide IUPAC Name: 2-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinoline-4-carboxamide Traditional Name: 2-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]cinchoninamide Formula: C17H12N4O2S2 MolecularWeight: 368.43278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)SCC3=NC(=NO3)C4=CSC=C4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)SCC3=NC(=NO3)C4=CSC=C4)C(=O)N

InChI

InChI=1S/C17H12N4O2S2/c18-16(22)12-7-15(19-13-4-2-1-3-11(12)13)25-9-14-20-17(21-23-14)10-5-6-24-8-10/h1-8H,9H2,(H2,18,22)