4-methoxy-3-[[5-(quinolin-8-yloxymethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzaldehyde

Systemtic Name: 4-methoxy-3-[[5-(quinolin-8-yloxymethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzaldehyde Openeye Name: 4-methoxy-3-[[5-(8-quinolyloxymethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzaldehyde CAS Name: 4-methoxy-3-[[[5-(8-quinolinyloxymethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzaldehyde IUPAC Name: 4-methoxy-3-[[5-(quinolin-8-yloxymethyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzaldehyde Traditional Name: 4-methoxy-3-[[[5-(8-quinolyloxymethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzaldehyde Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=O)CSC2=NN=C(O2)COC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)C=O)CSC2=NN=C(O2)COC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H17N3O4S/c1-26-17-8-7-14(11-25)10-16(17)13-29-21-24-23-19(28-21)12-27-18-6-2-4-15-5-3-9-22-20(15)18/h2-11H,12-13H2,1H3