2-[4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]phenoxy]acetonitrile Formula: C16H12N4OS MolecularWeight: 308.35768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NN=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N/N=C/C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C16H12N4OS/c17-9-10-21-13-7-5-12(6-8-13)11-18-20-16-19-14-3-1-2-4-15(14)22-16/h1-8,11H,10H2,(H,19,20)/b18-11+