3-ethoxy-4-[3-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propoxy]benzaldehyde

Systemtic Name: 3-ethoxy-4-[3-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propoxy]benzaldehyde Openeye Name: 4-[3-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propoxy]-3-ethoxy-benzaldehyde CAS Name: 3-ethoxy-4-[3-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]propoxy]benzaldehyde IUPAC Name: 4-[3-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]propoxy]-3-ethoxybenzaldehyde Traditional Name: 4-[3-[(5-benzyl-1,3,4-oxadiazol-2-yl)thio]propoxy]-3-ethoxy-benzaldehyde Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OCCCSC2=NN=C(O2)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OCCCSC2=NN=C(O2)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S/c1-2-25-19-13-17(15-24)9-10-18(19)26-11-6-12-28-21-23-22-20(27-21)14-16-7-4-3-5-8-16/h3-5,7-10,13,15H,2,6,11-12,14H2,1H3