2-[2-methoxy-4-[(Z)-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-methoxy-4-[(Z)-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanenitrile Openeye Name: 2-[2-methoxy-4-[(Z)-(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile CAS Name: 2-[2-methoxy-4-[(Z)-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile IUPAC Name: 2-[2-methoxy-4-[(Z)-(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile Traditional Name: 2-[2-methoxy-4-[(Z)-(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NN2C(=NNC2=S)C3=CC=CC=C3)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\N2C(=NNC2=S)C3=CC=CC=C3)OCC#N

InChI

InChI=1S/C18H15N5O2S/c1-24-16-11-13(7-8-15(16)25-10-9-19)12-20-23-17(21-22-18(23)26)14-5-3-2-4-6-14/h2-8,11-12H,10H2,1H3,(H,22,26)/b20-12-