2-[4-[(4-azanyl-1,3-benzothiazol-5-yl)oxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(4-azanyl-1,3-benzothiazol-5-yl)oxy]phenyl]ethanenitrile Openeye Name: 2-[4-[(4-amino-1,3-benzothiazol-5-yl)oxy]phenyl]acetonitrile CAS Name: 2-[4-[(4-amino-1,3-benzothiazol-5-yl)oxy]phenyl]acetonitrile IUPAC Name: 2-[4-[(4-amino-1,3-benzothiazol-5-yl)oxy]phenyl]acetonitrile Traditional Name: 2-[4-[(4-amino-1,3-benzothiazol-5-yl)oxy]phenyl]acetonitrile Formula: C15H11N3OS MolecularWeight: 281.33234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)OC2=C(C3=C(C=C2)SC=N3)N

Isomeric SMILES

C1=CC(=CC=C1CC#N)OC2=C(C3=C(C=C2)SC=N3)N

InChI

InChI=1S/C15H11N3OS/c16-8-7-10-1-3-11(4-2-10)19-12-5-6-13-15(14(12)17)18-9-20-13/h1-6,9H,7,17H2