2-[3-[(2-methyl-1,3-thiazol-4-yl)methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(2-methyl-1,3-thiazol-4-yl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(2-methylthiazol-4-yl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(2-methyl-4-thiazolyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(2-methyl-1,3-thiazol-4-yl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[(2-methylthiazol-4-yl)methylamino]phenoxy]acetonitrile Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CNC2=CC(=CC=C2)OCC#N

Isomeric SMILES

CC1=NC(=CS1)CNC2=CC(=CC=C2)OCC#N

InChI

InChI=1S/C13H13N3OS/c1-10-16-12(9-18-10)8-15-11-3-2-4-13(7-11)17-6-5-14/h2-4,7,9,15H,6,8H2,1H3