4-decoxy-N-[(E)-(5-quinolin-8-ylsulfanylfuran-2-yl)methylideneamino]benzamide

Systemtic Name: 4-decoxy-N-[(E)-(5-quinolin-8-ylsulfanylfuran-2-yl)methylideneamino]benzamide Openeye Name: 4-decoxy-N-[(E)-[5-(8-quinolylsulfanyl)-2-furyl]methyleneamino]benzamide CAS Name: 4-decoxy-N-[(E)-[5-(8-quinolinylthio)-2-furanyl]methylideneamino]benzamide IUPAC Name: 4-decoxy-N-[(E)-(5-quinolin-8-ylsulfanylfuran-2-yl)methylideneamino]benzamide Traditional Name: 4-decoxy-N-[(E)-[5-(8-quinolylthio)-2-furyl]methyleneamino]benzamide Formula: C31H35N3O3S MolecularWeight: 529.6929

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NN=CC2=CC=C(O2)SC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)N/N=C/C2=CC=C(O2)SC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C31H35N3O3S/c1-2-3-4-5-6-7-8-9-22-36-26-17-15-25(16-18-26)31(35)34-33-23-27-19-20-29(37-27)38-28-14-10-12-24-13-11-21-32-30(24)28/h10-21,23H,2-9,22H2,1H3,(H,34,35)/b33-23+