N-[(E)-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(E)-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[(E)-[3-(2-furylmethylsulfanylmethyl)-4-methoxy-phenyl]methyleneamino]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-[(E)-[3-[(2-furanylmethylthio)methyl]-4-methoxyphenyl]methylideneamino]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[(E)-[3-[(2-furfurylthio)methyl]-4-methoxy-benzylidene]amino]-2-(4-methoxyphenyl)cinchoninamide Formula: C31H27N3O4S MolecularWeight: 537.62878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN=CC4=CC(=C(C=C4)OC)CSCC5=CC=CO5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N/N=C/C4=CC(=C(C=C4)OC)CSCC5=CC=CO5

InChI

InChI=1S/C31H27N3O4S/c1-36-24-12-10-22(11-13-24)29-17-27(26-7-3-4-8-28(26)33-29)31(35)34-32-18-21-9-14-30(37-2)23(16-21)19-39-20-25-6-5-15-38-25/h3-18H,19-20H2,1-2H3,(H,34,35)/b32-18+