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

Systemtic Name: N-cyclopropyl-2-[[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[(3-p-phenetyl-1,2,4-oxadiazol-5-yl)methylthio]cinchoninamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

InChI

InChI=1S/C24H22N4O3S/c1-2-30-17-11-7-15(8-12-17)23-27-21(31-28-23)14-32-22-13-19(24(29)25-16-9-10-16)18-5-3-4-6-20(18)26-22/h3-8,11-13,16H,2,9-10,14H2,1H3,(H,25,29)