4-[2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-[[5-(prop-2-enylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-[[5-(allylamino)-1,3,4-thiadiazol-2-yl]thio]ethoxy]benzonitrile Formula: C14H14N4OS2 MolecularWeight: 318.41716

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(S1)SCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

C=CCNC1=NN=C(S1)SCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H14N4OS2/c1-2-7-16-13-17-18-14(21-13)20-9-8-19-12-5-3-11(10-15)4-6-12/h2-6H,1,7-9H2,(H,16,17)