4-[5-(4-phenoxybutylsulfanylmethyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(4-phenoxybutylsulfanylmethyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(4-phenoxybutylsulfanylmethyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-[(4-phenoxybutylthio)methyl]-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(4-phenoxybutylsulfanylmethyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-[(4-phenoxybutylthio)methyl]-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C19H20N2O3S MolecularWeight: 356.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCSCC2=NNC(=C3C=CC(=O)C=C3)O2

Isomeric SMILES

C1=CC=C(C=C1)OCCCCSCC2=NNC(=C3C=CC(=O)C=C3)O2

InChI

InChI=1S/C19H20N2O3S/c22-16-10-8-15(9-11-16)19-21-20-18(24-19)14-25-13-5-4-12-23-17-6-2-1-3-7-17/h1-3,6-11,21H,4-5,12-14H2