5-[3-(3,5-dimethylphenoxy)propylsulfanyl]-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazole

Systemtic Name: 5-[3-(3,5-dimethylphenoxy)propylsulfanyl]-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazole Openeye Name: 5-[3-(3,5-dimethylphenoxy)propylsulfanyl]-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazole CAS Name: 5-[3-(3,5-dimethylphenoxy)propylthio]-2-(2-pyrrolylidene)-3H-1,3,4-oxadiazole IUPAC Name: 5-[3-(3,5-dimethylphenoxy)propylsulfanyl]-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazole Traditional Name: 5-[3-(3,5-dimethylphenoxy)propylthio]-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazole Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCSC2=NNC(=C3C=CC=N3)O2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCSC2=NNC(=C3C=CC=N3)O2)C

InChI

InChI=1S/C17H19N3O2S/c1-12-9-13(2)11-14(10-12)21-7-4-8-23-17-20-19-16(22-17)15-5-3-6-18-15/h3,5-6,9-11,19H,4,7-8H2,1-2H3